8-Aminonaphthalene-2-carboxylic acid

HCID 13440887

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Basic information

CAS: 5043-19-6
Standard SMILES: Nc1cccc2ccc(C(=O)O)cc12
InChIKey: PBWULNOSRHQTHZ-UHFFFAOYSA-N
Molecular formula: C11H9NO2
Average molar mass: 187.19 g/mol
Monoisotopic mass: 187.06332853

Names & identifiers

Preferred name: 8-Aminonaphthalene-2-carboxylic acid
IUPAC: 8-aminonaphthalene-2-carboxylic acid
English name: 8-Amino-2-naphthoic acid
Molecular formula: C11H9NO2
Molecular weight: 187.19

Names & synonyms

5043-19-68-Aminonaphthalene-2-carboxylic acidDTXSID90540925RefChem:311736DTXCID00491712895-223-08-Amino-2-naphthoic acidSCHEMBL689325SCHEMBL30791056PBWULNOSRHQTHZ-UHFFFAOYSA-NMFCD18413487SY273202

Show more names

2-Naphthalenecarboxylic acid, 8-amino-

EN300-116573

Database identifiers

CAS: 5043-19-6
PubChem CID: 13440887
DTXSID: DTXSID90540925
EC Number: 895-223-0
Nikkaji: J36.386C

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 63.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 14
Formal charge: 0
Complexity: 229

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): 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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.