2-Aminophenylacetic acid

HCID 583776CAS 3342-78-7

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Basic information

Standard SMILES: Nc1ccccc1CC(=O)O
InChIKey: KHMNCHDUSFCTGK-UHFFFAOYSA-N
Molecular formula: C8H9NO2
Average molar mass: 151.165 g/mol
Monoisotopic mass: 151.06332853

Names & identifiers

Preferred name: 2-Aminophenylacetic acid
IUPAC: (2-Aminophenyl)acetic acid
English name: 2-AMINOPHENYLACETIC ACID
Molecular formula: C8H9NO2
Molecular weight: 151.16

Names & synonyms

2-(2-AMINOPHENYL)ACETIC ACIDRARECHEM AL BO 1334O-AMINOPHENYLACETIC ACID2-AMINOPHENYLACETIC ACID2-aMino-benzeneacetic acid2-AMINOPHENYLACETIC ACID,98+%2-AMINOPHENYLACETIC ACID 95%Benzeneacetic acid, 2- aMino-2-phenylacetic acid amino ester2-AMINOPHENYLACETIC ACID USP/EP/BP

Database identifiers

CAS: 3342-78-7
PubChem CID: 583776
DTXSID: DTXSID50342684
ChEBI: CHEBI:149652
EC Number: 621-176-0
Nikkaji: J27.581F

Properties

Physicochemical properties

Melting point: 123 · 123-127 °C(lit.)
Boiling point: 344.4 · 344.4±17.0 °C(Predicted)
Density: 1.268 · 1.268±0.06 g/cm3(Predicted)
storage temp.: RT, protect from light
pka: 4.38 · 4.38±0.10(Predicted)
form: solid
Appearance: Light brown to brown Solid
optical activity: 20 · [α]20/D 31.5°, c = 1 in H2O
Stability: Light Sensitive
InChI: 1S/C8H9NO2/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4H,5,9H2,(H,10,11)
InChIKey: KHMNCHDUSFCTGK-UHFFFAOYSA-N
SMILES: Nc1ccccc1CC(O)=O
CAS DataBase Reference: 3342 · 3342-78-7(CAS DataBase Reference)
UNSPSC Code: 12352106 · 12352106
NACRES: 21 · NA.21
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H319
Precautionary statements: 305 · P305+P351+P338
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38-36
Safety Statements: 26 · 26-36
WGK Germany: 3 · 3
HazardClass: IRRITANT
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 4 OralEye · Acute Tox. 4 OralEye Irrit. 2

Safety & regulation

Safety data

wgk: 3
risk_code: 36/37/38-36
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36
hazard_class: IRRITANT
Storage Class: 11 - Combustible Solids
Hazard statements: H302-H319
Hazard Classifications: Acute Tox. 4 OralEye Irrit. 2
Precautionary statements: P305+P351+P338

Chemistry & industry

Applications

Uses2-Aminophenylacetic acid is a useful synthetic intermediate.

Upstream & downstream products

Upstream raw materials

Downstream products

Cefaclor

Suppliers50 total

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

上海莉凯化工技术有限公司16628776521 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

Additional notes · 1 item

DefinitionChEBI: 2-aminophenylacetic acid is a member of the class of phenylacetic acids that is phenylacetic acid which carries an amino group at position 2 of the phenyl ring. A fungal metabolite produced by Colletotrichum gloeosporioides. It has a role as a fungal metabolite. It is a substituted aniline and a member of phenylacetic acids.