2-Amino-4-methoxybenzoic acid

HCID 351010CAS 4294-95-5
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(C(=O)O)c(N)c1
InChIKey
HHNWXQCVWVVVQZ-UHFFFAOYSA-N
Molecular formula
C8H9NO3
Average molar mass
167.16 g/mol
Monoisotopic mass
167.05824315

Names & identifiers

Preferred name
2-Amino-4-methoxybenzoic acid
IUPAC
2-amino-4-methoxybenzoic acid
English name
2-Amino-4-methoxy-benzoic acid
Molecular formula
C8H9NO3
Molecular weight
167.16

Names & synonyms

2-Amino-4-methoxybenzoic acidDTXSID70325772RefChem:464318DTXCID40276888630-055-14294-95-54-Methoxyanthranilic acid2-amino-4-methoxy-benzoic acidMFCD006677292-Amino-p-anisic AcidBENZOIC ACID, 2-AMINO-4-METHOXY-2-Amino-4-methoxybenzoic Acid; NSC 517873
Show more names
Metoclopramide Impurity 542-AMino-4-Metnoxybenzoic acid2-amine-4-methoxybenzoic acid2-azanyl-4-methoxy-benzoic acid
4-methoxy-anthranilic acid4-Methoxy anthranilic acidMetoclopramide Impurity 1092-Amino-4-methoxybenzoicacidSCHEMBL147211m-Anisidine-6-carboxylic Acid2-Amino-4-methoxy benzoic acid4-methoxy-2-amino-benzoic acid

Database identifiers

CAS
4294-95-5
PubChem CID
351010
DTXSID
DTXSID70325772
EC Number
630-055-1
Nikkaji
J1.402.047K

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
72.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
12

Physicochemical properties

Melting point
175 · 175-180 °C
Boiling point
339.8 · 339.8±27.0 °C(Predicted)
Density
1.303 · 1.303±0.06 g/cm3(Predicted)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
form
powder to crystal
pka
5.21 · 5.21±0.10(Predicted)

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H302 (85.4%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (16.7%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (16.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (16.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (85.4%)；Skin Irrit. 2 (16.7%)；Eye Irrit. 2 (16.7%)；STOT SE 3 (16.7%)

Safety data

wgk
3
hs_code
29225090
risk_code
36/37/38-22
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xn

Chemistry & industry

Applications

Uses2-Amino-4-methoxybenzoic Acid, is an organic building block used in the synthesis of various chemical compounds.

Upstream & downstream products

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
科瑞迪化学400-821-5857 021-64326257 · [email protected]

Related reactions

57 records
New reaction record

Linked notes

Loading…