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Home > Boronic Acids > 352535-95-6
352535-95-6 | 2,3-DICHLORO-4-METHYLPHENYLBORONIC ACID
CAS No: 352535-95-6 Catalog No: AG00CTB3 MDL No:
Product Description
Catalog Number:
AG00CTB3
Chemical Name:
2,3-DICHLORO-4-METHYLPHENYLBORONIC ACID
CAS Number:
352535-95-6
Molecular Formula:
C7H7BCl2O2
Molecular Weight:
204.8463
IUPAC Name:
(2,3-dichloro-4-methylphenyl)boronic acid
InChI:
InChI=1S/C7H7BCl2O2/c1-4-2-3-5(8(11)12)7(10)6(4)9/h2-3,11-12H,1H3
InChI Key:
NKYHVKCVTBFIPB-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1Cl)Cl)C)O
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.992g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
204.841g/mol
Monoisotopic Mass:
203.992g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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