N-(2-Hydroxy-4-methylphenyl)acetamide

HCID 83437

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Basic information

CAS: 13429-10-2
Standard SMILES: CC(=O)Nc1ccc(C)cc1O
InChIKey: HTVPAACTHAQQAS-UHFFFAOYSA-N
Molecular formula: C9H11NO2
Average molar mass: 165.19 g/mol
Monoisotopic mass: 165.07897859

Overview

structure in first source

Names & identifiers

Preferred name: N-(2-Hydroxy-4-methylphenyl)acetamide
IUPAC: N-(2-hydroxy-4-methylphenyl)acetamide
English name: 2'-Hydroxy-p-acetotoluidide, 98
Molecular formula: C9H11NO2
Molecular weight: 165.19

Names & synonyms

N-(2-hydroxy-4-methylphenyl)acetamide13429-10-2Acetamide, N-(2-hydroxy-4-methylphenyl)-DTXSID9065449RefChem:551686DTXCID7034200630-760-4MFCD000120612'-HYDROXY-P-ACETOTOLUIDIDE, 986-Acetamino-m-kresolAcetamide,N-(2-hydroxy-4-methylphenyl)-SCHEMBL4520067

Show more names

5-Methyl-2-acetamidophenol3-Methyl-6-acetamidophenol2-Acetamido-5-methylphenol4'-Methyl-2'-hydroxyacetoanilide2'-Hydroxy-4'-methylacetoaniliden-(2-hydroxy-4-methylphenyl)-acetamidN-(2-hydroxy-4-methyl-phenyl)ethanamide

SCHEMBL27731986SCHEMBL282974722-Acetamido-5-methylphenol, 97%ALBB-005865AKOS000321763N-(2-hydroxy-4-methyl-phenyl)acetamideLS-02163SY082270

Database identifiers

CAS: 13429-10-2
PubChem CID: 83437
DTXSID: DTXSID9065449
EC Number: 630-760-4
Nikkaji: J421.882E

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 49.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 12
Formal charge: 0
Complexity: 170

Physicochemical properties

Melting point: 170 · 170-172 °C(lit.)
form: Solid
InChI: 1S/C9H11NO2/c1-6-3-4-8(9(12)5-6)10-7(2)11/h3-5,12H,1-2H3,(H,10,11)
InChIKey: HTVPAACTHAQQAS-UHFFFAOYSA-N
SMILES: CC(=O)Nc1ccc(C)cc1O
EPA Substance Registry System: Acetamide, N-(2-hydroxy-4-methylphenyl)- (13429-10-2)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs: Respiratory system
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-37/39
WGK Germany: 3 · 3
TSCA: TSCA listed
HazardClass: IRRITANT
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.