200,000+ products from a single source!
sales@angenechem.com
177734-84-8 | [1,1'-Biphenyl]-3-carboxylic acid, 3',5'-dimethyl-
CAS No: 177734-84-8 Catalog No: AG0025IC MDL No:MFCD06201437
Product Description
Catalog Number:
AG0025IC
Chemical Name:
[1,1'-Biphenyl]-3-carboxylic acid, 3',5'-dimethyl-
CAS Number:
177734-84-8
Molecular Formula:
C15H14O2
Molecular Weight:
226.2705
MDL Number:
MFCD06201437
IUPAC Name:
3-(3,5-dimethylphenyl)benzoic acid
InChI:
InChI=1S/C15H14O2/c1-10-6-11(2)8-14(7-10)12-4-3-5-13(9-12)15(16)17/h3-9H,1-2H3,(H,16,17)
InChI Key:
PDMBLHWIZAYFNX-UHFFFAOYSA-N
SMILES:
Cc1cc(C)cc(c1)c1cccc(c1)C(=O)O
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.099g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.275g/mol
Monoisotopic Mass:
226.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.