AG0038OB

51934-39-5 | 7-bromo-1-naphthoic acid

AG0038OB

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CAS Number	51934-39-5
Catalog Number	AG0038OB(AGN-PC-0JNR36)
Chemical Name	7-bromo-1-naphthoic acid
IUPAC Name	7-bromonaphthalene-1-carboxylic acid
InChI	InChI=1S/C11H7BrO2/c12-8-5-4-7-2-1-3-9(11(13)14)10(7)6-8/h1-6H,(H,13,14)
InChI Key	OMVHZFPTYXFWFU-UHFFFAOYSA-N
MDL Number	MFCD11502678
Molecular Formula	C11H7BrO2
Molecular Weight	251.0761
NSC Number	74919
SMILES	BrC1=CC=C2C=CC=C(C2=C1)C(=O)O
Synonyms	7-Bromo-1-naphthoic acid, 51934-39-5, 7-bromonaphthalene-1-carboxylic acid, AK136183, NSC74919, AC1L5MMM, AC1Q5TJW, NCIOpen2_004044, SCHEMBL1668812, CTK4J5140, DTXSID00291330, OMVHZFPTYXFWFU-UHFFFAOYSA-N, KS-00000RN4, ZINC1673212, 7-Bromo-1-naphthalenecarboxylic Acid, MFCD11502678, NSC-74919, AKOS022171764, DS-5309, FCH1404001, AJ-29313, AX8257641, DB-083710, CS-0032472, FT-0723668, ST24045586, AR-1H3221, CID252733, 1-Naphthalenecarboxylic acid, 7-bromo-, 522-53-2,

Complexity	229
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	249.963g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	251.079g/mol
Monoisotopic Mass	249.963g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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