AG0024QT

176548-72-4 | Benzoic acid, 3-fluoro-5-methoxy-

AG0024QT

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CAS Number	176548-72-4
Catalog Number	AG0024QT(AGN-PC-03I283)
Chemical Name	Benzoic acid, 3-fluoro-5-methoxy-
IUPAC Name	3-fluoro-5-methoxybenzoic acid
InChI	InChI=1S/C8H7FO3/c1-12-7-3-5(8(10)11)2-6(9)4-7/h2-4H,1H3,(H,10,11)
InChI Key	WUHJSLPINVJGPW-UHFFFAOYSA-N
MDL Number	MFCD02684298
Molecular Formula	C8H7FO3
Molecular Weight	170.1378
SMILES	FC1=CC(=CC(=C1)C(=O)O)OC
Synonyms	3-FLUORO-5-METHOXYBENZOIC ACID, 176548-72-4, Benzoic acid, 3-fluoro-5-methoxy-, Benzoic acid,3-fluoro-5-methoxy-, 3-fluoro-5-methoxy-benzoic acid, ACMC-209ebl, SCHEMBL573257, 3-Fluoro-5-methoxybenzoicAcid, 3-fluoro-5-methoxy benzoic acid, CTK4D6243, KS-00000CVB, DTXSID50620499, WUHJSLPINVJGPW-UHFFFAOYSA-N, 3-fluoranyl-5-methoxy-benzoic acid, ANW-22831, MFCD08235092, SBB088380, ZINC12471621, AKOS005257634, AB43741, CS-W003479, FS-3190, RP23219, TRA0052145, AJ-62323, AK-48893, BR-48893, SY023334, 3-FLUORO-5-METHOXYBENZOIC ACID 98, AB0022902, AB1006241, DB-031124, TR-008046, 4CH-009886, AM20050427, FT-0682920, ST24028529, W3858, B-3450, MFCD08235092 (97+%), A812193, J-512528, I01-11713, null, C8H7FO3,

Complexity	172
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.038g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	170.139g/mol
Monoisotopic Mass	170.038g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number