AG006VPU

508235-16-3 | 2,3-Difluoro-4-methylphenylboronicacid

AG006VPU

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CAS Number	508235-16-3
Catalog Number	AG006VPU(AGN-PC-044Q4H)
Chemical Name	2,3-Difluoro-4-methylphenylboronicacid
IUPAC Name	(2,3-difluoro-4-methylphenyl)boronic acid
InChI	InChI=1S/C7H7BF2O2/c1-4-2-3-5(8(11)12)7(10)6(4)9/h2-3,11-12H,1H3
InChI Key	ZSNYLXVAUJWEMN-UHFFFAOYSA-N
MDL Number	MFCD09751348
Molecular Formula	C7H7BF2O2
Molecular Weight	171.9371
SMILES	c1(c(ccc(c1F)B(O)O)C)F
Synonyms	(2,3-Difluoro-4-methylphenyl)boronic acid, 508235-16-3, 2,3-DIFLUORO-4-METHYLPHENYLBORONIC ACID, ACMC-209kqb, SCHEMBL10091339, CTK8B1785, DTXSID00634768, ANW-31137, MFCD09751348, AKOS006327524, ZINC169746443, CS-W000946, AK-92848, DS-17697, TC-119882, ST24020128, V6287, A-3328, I04-2797, C7H7BF2O2, ACN-044186, (2,3-Difluoro-4-methylphenyl)boronicacid,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.051g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	171.938g/mol
Monoisotopic Mass	172.051g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	40.5A^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

Certificate of Analysis

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