200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1214369-81-9
1214369-81-9 | [1,1'-Biphenyl]-3-carboxylic acid, 5-methoxy-
CAS No: 1214369-81-9 Catalog No: AG0014XO MDL No:MFCD14702065
Product Description
Catalog Number:
AG0014XO
Chemical Name:
[1,1'-Biphenyl]-3-carboxylic acid, 5-methoxy-
CAS Number:
1214369-81-9
Molecular Formula:
C14H12O3
Molecular Weight:
228.2433
MDL Number:
MFCD14702065
IUPAC Name:
3-methoxy-5-phenylbenzoic acid
InChI:
InChI=1S/C14H12O3/c1-17-13-8-11(7-12(9-13)14(15)16)10-5-3-2-4-6-10/h2-9H,1H3,(H,15,16)
InChI Key:
RJNXRRZKLNCRKQ-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1)C(=O)O)c1ccccc1
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.079g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.247g/mol
Monoisotopic Mass:
228.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.