200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 91983-26-5
91983-26-5 | (4-(Cyanomethyl)phenyl)boronic acid
CAS No: 91983-26-5 Catalog No: AG006GXP MDL No:MFCD01632200
Product Description
Catalog Number:
AG006GXP
Chemical Name:
(4-(Cyanomethyl)phenyl)boronic acid
CAS Number:
91983-26-5
Molecular Formula:
C8H8BNO2
Molecular Weight:
160.9656
MDL Number:
MFCD01632200
IUPAC Name:
[4-(cyanomethyl)phenyl]boronic acid
InChI:
InChI=1S/C8H8BNO2/c10-6-5-7-1-3-8(4-2-7)9(11)12/h1-4,11-12H,5H2
InChI Key:
YKVMTTIYBSVPEQ-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)CC#N)O
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.065g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
160.967g/mol
Monoisotopic Mass:
161.065g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.