[4-amino-3-(hydroxymethyl)phenyl]methanol (CED0210383)

Record Information

Version

1.0

Creation Date

2026-08-24 12:37:31 UTC

Update Date

2026-08-24 12:37:31 UTC

SynCED ID

CED0210383

Secondary Accession Numbers

CHEM249392

Identification

Common Name

[4-amino-3-(hydroxymethyl)phenyl]methanol

Class

Small Molecule

Description

[4-amino-3-(hydroxymethyl)phenyl]methanol belongs to the benzyl alcohols, a subclass of benzene and substituted derivatives within the organic compounds. It is categorized under the superclass of benzenoids. This compound has the chemical formula C8H11NO2 and an average molecular weight of 153.18 g/mol.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₈H₁₁NO₂

Average Molecular Mass

153.180 g/mol

Monoisotopic Mass

153.079 g/mol

CAS Registry Number

1009314-88-8

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C8H11NO2/c9-8-2-1-6(4-10)3-7(8)5-11/h1-3,10-11H,4-5,9H2

InChI Key

ZYJKONDZYOWOHE-UHFFFAOYSA-N

Chemical Taxonomy

Classification

Not classified

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Not Available

Spectra

Not Available

Toxicity Profile

Toxicity Values

Toxicity Value	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Toxicity Rating	Reference
2012.0 Log mg/kg [1100:3600]	Rat	LD50	oral	predicted	Not Available	Not Available

Toxicity / Toxin Class

Not Available

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Health Effects

Health Effect	Relationship	Direction	Description	Reference

Exposure Sources

Source ID	Source	Sector	Reference
CEDs000650	Purses Luggage Hand Bags?Purses, luggage, and handbags are often manufactured using synthetic materials such as polyvinyl chloride (PVC), polyurethane, and various types of nylon.	Textiles, leather & furnishings	PubChem

Pathways

0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Carbonic anhydrase 9	Q16790	Humans	Predicted (SEA)	Prediction Confidence Score 0.301 Applicability Domain 0.355 Statistical Significance 0.0342 Supporting Reference Compounds 372 E-value 266.556
Click to view 3D structure	Carbonic anhydrase 14	Q9ULX7	Humans	Predicted (SEA)	Prediction Confidence Score 0.301 Applicability Domain 0.355 Statistical Significance 0.0154 Supporting Reference Compounds 172 E-value 120.121
Click to view 3D structure	Carbonic anhydrase 15	Q99N23	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.301 Applicability Domain 0.355 Statistical Significance 0.0079 Supporting Reference Compounds 78 E-value 61.1895
Click to view 3D structure	Carbonic anhydrase 5B, mitochondrial	Q9Y2D0	Humans	Predicted (SEA)	Prediction Confidence Score 0.301 Applicability Domain 0.355 Statistical Significance 0.0123 Supporting Reference Compounds 157 E-value 95.7545
Click to view 3D structure	Carbonic anhydrase 6	P23280	Humans	Predicted (SEA)	Prediction Confidence Score 0.293 Applicability Domain 0.355 Statistical Significance 0.0136 Supporting Reference Compounds 151 E-value 106.108
Click to view 3D structure	Carbonic anhydrase 12	O43570	Humans	Predicted (SEA)	Prediction Confidence Score 0.293 Applicability Domain 0.355 Statistical Significance 0.0367 Supporting Reference Compounds 332 E-value 285.629
Click to view 3D structure	Carbonic anhydrase 4	P22748	Humans	Predicted (SEA)	Prediction Confidence Score 0.286 Applicability Domain 0.355 Statistical Significance 0.0194 Supporting Reference Compounds 193 E-value 151.339
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	Prediction Confidence Score 0.28 Applicability Domain 0.355 Statistical Significance 0.075 Supporting Reference Compounds 472 E-value 584.258
Click to view 3D structure	Carbonic anhydrase 5A, mitochondrial	P35218	Humans	Predicted (SEA)	Prediction Confidence Score 0.279 Applicability Domain 0.355 Statistical Significance 0.0274 Supporting Reference Compounds 165 E-value 213.307
Click to view 3D structure	Carbonic anhydrase 13	Q9D6N1	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.275 Applicability Domain 0.333 Statistical Significance 0.0113 Supporting Reference Compounds 70 E-value 87.7361
Click to view 3D structure	Carbonic anhydrase 1	P00915	Humans	Predicted (SEA)	Prediction Confidence Score 0.271 Applicability Domain 0.355 Statistical Significance 0.0781 Supporting Reference Compounds 407 E-value 607.691
Click to view 3D structure	Carbonic anhydrase 7	P43166	Humans	Predicted (SEA)	Prediction Confidence Score 0.266 Applicability Domain 0.355 Statistical Significance 0.0504 Supporting Reference Compounds 242 E-value 392.671
Click to view 3D structure	Carbonic anhydrase 2	Q3I4V7	Cryptococcus neoformans	Predicted (SEA)	Prediction Confidence Score 0.266 Applicability Domain 0.355 Statistical Significance 0.013 Supporting Reference Compounds 60 E-value 101.204
Click to view 3D structure	Carbonic anhydrase	Q5AJ71	Candida albicans (strain SC5314 / ATCC MYA-2876) (Yeast)	Predicted (SEA)	Prediction Confidence Score 0.266 Applicability Domain 0.355 Statistical Significance 0.0158 Supporting Reference Compounds 68 E-value 123.235
Click to view 3D structure	Beta-carbonic anhydrase 1	P9WPJ7	Mycobacterium tuberculosis	Predicted (SEA)	Prediction Confidence Score 0.266 Applicability Domain 0.355 Statistical Significance 0.0135 Supporting Reference Compounds 55 E-value 105.486
Click to view 3D structure	Carbonic anhydrase 4	Q95323	Bos taurus	Predicted (SEA)	Prediction Confidence Score 0.257 Applicability Domain 0.355 Statistical Significance 0.022 Supporting Reference Compounds 64 E-value 170.957
Click to view 3D structure	Carbonate dehydratase	B2V8E3	Sulfurihydrogenibium sp. (strain YO3AOP1)	Predicted (SEA)	Prediction Confidence Score 0.257 Applicability Domain 0.355 Statistical Significance 0.0083 Supporting Reference Compounds 40 E-value 64.3035
Click to view 3D structure	Carbonic anhydrase	O24855	Helicobacter pylori (strain ATCC 700392 / 26695) (Campylobacterpylori)	Predicted (SEA)	Prediction Confidence Score 0.257 Applicability Domain 0.355 Statistical Significance 0.0092 Supporting Reference Compounds 38 E-value 71.3099
Click to view 3D structure	Carbonic anhydrase	Q6FTL6	Candida glabrata CBS 138	Predicted (SEA)	Prediction Confidence Score 0.257 Applicability Domain 0.355 Statistical Significance 0.0157 Supporting Reference Compounds 46 E-value 122.301
Click to view 3D structure	Alpha carbonic anhydrase	B5SU02	Stylophora pistillata	Predicted (SEA)	Prediction Confidence Score 0.257 Applicability Domain 0.355 Statistical Significance 0.0083 Supporting Reference Compounds 43 E-value 64.6927
Click to view 3D structure	Carbonic anhydrase	P53615	Saccharomyces cerevisiae S288c	Predicted (SEA)	Prediction Confidence Score 0.257 Applicability Domain 0.355 Statistical Significance 0.0076 Supporting Reference Compounds 34 E-value 59.3211
Click to view 3D structure	Carbonic anhydrase, alpha family	Q31FD6	Thiomicrospira crunogena	Predicted (SEA)	Prediction Confidence Score 0.257 Applicability Domain 0.355 Statistical Significance 0.0083 Supporting Reference Compounds 41 E-value 64.3035
Click to view 3D structure	Carbonic anhydrase	C0IX24	Stylophora pistillata	Predicted (SEA)	Prediction Confidence Score 0.257 Applicability Domain 0.355 Statistical Significance 0.0083 Supporting Reference Compounds 41 E-value 64.6927
Click to view 3D structure	Astrosclerin-3	A6YCJ1	Astrosclera willeyana	Predicted (SEA)	Prediction Confidence Score 0.252 Applicability Domain 0.355 Statistical Significance 0.0092 Supporting Reference Compounds 44 E-value 71.8548
Click to view 3D structure	Thioredoxin reductase 2, mitochondrial	Q9Z0J5	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.244 Applicability Domain 0.244 Low confidence Statistical Significance 1.00e-04 Supporting Reference Compounds 1 E-value 0.778492