AG007J8C

153122-60-2 | (4-Chloro-2-fluoro-5-methoxyphenyl)boronic acid

AG007J8C

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CAS Number	153122-60-2
Catalog Number	AG007J8C(AGN-PC-0ND1Z2)
Chemical Name	(4-Chloro-2-fluoro-5-methoxyphenyl)boronic acid
IUPAC Name	(4-chloro-2-fluoro-5-methoxyphenyl)boronic acid
InChI	InChI=1S/C7H7BClFO3/c1-13-7-2-4(8(11)12)6(10)3-5(7)9/h2-3,11-12H,1H3
InChI Key	GCQRPPPUHXEHJO-UHFFFAOYSA-N
MDL Number	MFCD12912365
Molecular Formula	C7H7BClFO3
Molecular Weight	204.3911
SMILES	COC1=CC(B(O)O)=C(F)C=C1Cl
Synonyms	153122-60-2, (4-Chloro-2-fluoro-5-methoxyphenyl)boronic acid, 4-CHLORO-2-FLUORO-5-METHOXYPHENYLBORONIC ACID, ACMC-209d8s, SCHEMBL6176724, CTK4C7711, DTXSID20448809, GCQRPPPUHXEHJO-UHFFFAOYSA-N, KS-00001TR9, ANW-21434, MFCD12912365, AKOS015850114, ZINC169933910, FCH1378380, AK-84168, PC412118, AX8161524, TR-035788, CS-0061949, FT-0686327, X0542, 1N-902, 4-chloro-2-fluoro-5-methoxybenzeneboronic acid, B-2645, I04-2559, Boronic acid, (4-chloro-2-fluoro-5-methoxyphenyl)-, C7H7BClFO3, CID10932600, 2-Chloro-3-fluoropyridine-4-boronic acid, (4-chloro-2-fluoro-5-methoxy-phenyl)boronic Acid,

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-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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