AG00367R

944129-07-1 | 4-Chloro-2-fluoro-3-methoxyphenylboronic acid

AG00367R

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CAS Number	944129-07-1
Catalog Number	AG00367R(AGN-PC-0WAA7O)
Chemical Name	4-Chloro-2-fluoro-3-methoxyphenylboronic acid
EC Number	696-001-4
IUPAC Name	(4-chloro-2-fluoro-3-methoxyphenyl)boronic acid
InChI	InChI=1S/C7H7BClFO3/c1-13-7-5(9)3-2-4(6(7)10)8(11)12/h2-3,11-12H,1H3
InChI Key	GDJCQSNQOHRAGY-UHFFFAOYSA-N
MDL Number	MFCD17015742
Molecular Formula	C7H7BClFO3
Molecular Weight	204.3911
SMILES	ClC1=C(C(=C(C=C1)B(O)O)F)OC
Synonyms	944129-07-1, (4-Chloro-2-fluoro-3-methoxyphenyl)boronic acid, 4-CHLORO-2-FLUORO-3-METHOXYPHENYLBORONIC ACID, 4-Chloro-2-fluoro-3-methoxyphenyl boronic acid, ACMC-209rro, SCHEMBL718784, CTK5H6551, DTXSID20657510, GDJCQSNQOHRAGY-UHFFFAOYSA-N, ANW-40258, MFCD17015742, AKOS015850507, ZINC169746177, AM85019, FCH1351946, BC000720, PC412304, SC-70061, AX8228646, TR-038512, ST24020543, V9427, B-4795, (4-chloro-2-fluoro-3-methoxyphenyl)-boronic acid, I04-2438, C7H7BClFO3, ACN-036603, (4-Chloro-2-fluoro-3-methoxyphenyl)boronicacid, EC 696-001-4,

Complexity	172
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	204.016g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	204.388g/mol
Monoisotopic Mass	204.016g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	49.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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