200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 397843-61-7
397843-61-7 | 4-(PHENOXYMETHYL)PHENYLBORONIC ACID
CAS No: 397843-61-7 Catalog No: AG00C8BE MDL No:MFCD09966155
Product Description
Catalog Number:
AG00C8BE
Chemical Name:
4-(PHENOXYMETHYL)PHENYLBORONIC ACID
CAS Number:
397843-61-7
Molecular Formula:
C13H13BO3
Molecular Weight:
228.0515
MDL Number:
MFCD09966155
IUPAC Name:
[4-(phenoxymethyl)phenyl]boronic acid
InChI:
InChI=1S/C13H13BO3/c15-14(16)12-8-6-11(7-9-12)10-17-13-4-2-1-3-5-13/h1-9,15-16H,10H2
InChI Key:
IXDHTLPOOZIZJX-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)COc1ccccc1)O
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.096g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
228.054g/mol
Monoisotopic Mass:
228.096g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.