AG00ABHE

1573-91-7 | 2-Naphthalenecarboxylic acid, 4-hydroxy-

AG00ABHE

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CAS Number	1573-91-7
Catalog Number	AG00ABHE(AGN-PC-00KSO6)
Chemical Name	2-Naphthalenecarboxylic acid, 4-hydroxy-
IUPAC Name	4-hydroxynaphthalene-2-carboxylic acid
InChI	InChI=1S/C11H8O3/c12-10-6-8(11(13)14)5-7-3-1-2-4-9(7)10/h1-6,12H,(H,13,14)
InChI Key	NIOAVQYSSKOCQP-UHFFFAOYSA-N
MDL Number	MFCD12405016
Molecular Formula	C11H8O3
Molecular Weight	188.1794
SMILES	Oc1c2c(cc(c1)C(=O)O)cccc2
Synonyms	4-hydroxy-2-naphthoic acid, 1573-91-7, 4-hydroxynaphthalene-2-carboxylic acid, 2-Naphthalenecarboxylic acid, 4-hydroxy-, 1-hydroxy-3-naphthoic acid, 3-Naphthol-1-carboxylic acid, SCHEMBL163553, NIOAVQYSSKOCQP-UHFFFAOYSA-N, CS-B0399, MFCD12405016, ZINC39390775, AKOS022505551, 2-Naphthalenecarboxylic acid,4-hydroxy-, 4-Hydroxy-naphthalene-2-carboxylic acid, CS-13416, Z1925930029,

Complexity	227
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.047g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	188.182g/mol
Monoisotopic Mass	188.047g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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