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Home > Boronic Acids > 1451391-43-7
1451391-43-7 | 4-cyano-2,6-dimethylphenylboronic acid
CAS No: 1451391-43-7 Catalog No: AG00AR38 MDL No:
Product Description
Catalog Number:
AG00AR38
Chemical Name:
4-cyano-2,6-dimethylphenylboronic acid
CAS Number:
1451391-43-7
IUPAC Name:
(4-cyano-2,6-dimethylphenyl)boronic acid
InChI:
InChI=1S/C9H10BNO2/c1-6-3-8(5-11)4-7(2)9(6)10(12)13/h3-4,12-13H,1-2H3
InChI Key:
JTJKZJPBCISPOI-UHFFFAOYSA-N
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.08g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
174.994g/mol
Monoisotopic Mass:
175.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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