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Home > Boronic Acids > 957120-97-7
957120-97-7 | (3,5-Dichloro-2-methylphenyl);boronic acid
CAS No: 957120-97-7 Catalog No: AG00H80T MDL No:MFCD09800882
Product Description
Catalog Number:
AG00H80T
Chemical Name:
(3,5-Dichloro-2-methylphenyl);boronic acid
CAS Number:
957120-97-7
Molecular Formula:
C7H7BCl2O2
Molecular Weight:
204.8463
MDL Number:
MFCD09800882
IUPAC Name:
(3,5-dichloro-2-methylphenyl)boronic acid
InChI:
InChI=1S/C7H7BCl2O2/c1-4-6(8(11)12)2-5(9)3-7(4)10/h2-3,11-12H,1H3
InChI Key:
SHLANOIYUAXDGG-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)c(c(c1)B(O)O)C
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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