200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 164413-77-8
164413-77-8 | Boronic acid, B-[4-(chloromethyl)phenyl]-
CAS No: 164413-77-8 Catalog No: AG001UVG MDL No:MFCD07363850
Product Description
Catalog Number:
AG001UVG
Chemical Name:
Boronic acid, B-[4-(chloromethyl)phenyl]-
CAS Number:
164413-77-8
Molecular Formula:
C7H8BClO2
Molecular Weight:
170.4012
MDL Number:
MFCD07363850
IUPAC Name:
[4-(chloromethyl)phenyl]boronic acid
InChI:
InChI=1S/C7H8BClO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4,10-11H,5H2
InChI Key:
AAMFQEQPAXVUJU-UHFFFAOYSA-N
SMILES:
ClCc1ccc(cc1)B(O)O
Properties
Complexity:
113
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.031g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
170.399g/mol
Monoisotopic Mass:
170.031g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
© 2019 Angene International Limited. All rights Reserved.