AG00CMR0

314241-04-8 | 2-fluoro-4-(methoxycarbonyl)benzoic acid

AG00CMR0

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	314241-04-8
Catalog Number	AG00CMR0(AGN-PC-0O8U3B)
Chemical Name	2-fluoro-4-(methoxycarbonyl)benzoic acid
IUPAC Name	2-fluoro-4-methoxycarbonylbenzoic acid
InChI	InChI=1S/C9H7FO4/c1-14-9(13)5-2-3-6(8(11)12)7(10)4-5/h2-4H,1H3,(H,11,12)
InChI Key	XRXCBKITDLPTEF-UHFFFAOYSA-N
MDL Number	MFCD20640446
Molecular Formula	C9H7FO4
Molecular Weight	198.1479
SMILES	COC(=O)C1=CC(F)=C(C=C1)C(O)=O
Synonyms	2-fluoro-4-(methoxycarbonyl)benzoic acid, 314241-04-8, 1,4-Benzenedicarboxylic acid, 2-fluoro-, 4-methyl ester, SCHEMBL2301205, DTXSID00731468, XRXCBKITDLPTEF-UHFFFAOYSA-N, 3388AB, MFCD20640446, ZINC77020730, AKOS016009163, MCULE-7475378322, NE19587, 2-Fluoroterephthalic acid 4-methyl ester, AS-50070, 2-Fluoro-terephthalic acid 4-methyl ester, AJ-122364, Z1723418861, C9H7FO4, 2-fluoro-4-(methoxycarbonyl)benzoicacid,

Complexity	241
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	198.033g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	198.149g/mol
Monoisotopic Mass	198.033g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	63.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H320-H335
Packing Group
Precautionary statements	P264-P270-P301+P312-P330
UN Code

Certificate of Analysis

Lot Number