200,000+ products from a single source!
sales@angenechem.com
167627-35-2 | [1,1'-Biphenyl]-4-carboxylic acid, 2-methyl-4'-(phenylmethoxy)-
CAS No: 167627-35-2 Catalog No: AG001XI6 MDL No:MFCD18322890
Product Description
Catalog Number:
AG001XI6
Chemical Name:
[1,1'-Biphenyl]-4-carboxylic acid, 2-methyl-4'-(phenylmethoxy)-
CAS Number:
167627-35-2
Molecular Formula:
C21H18O3
Molecular Weight:
318.3658
MDL Number:
MFCD18322890
IUPAC Name:
3-methyl-4-(4-phenylmethoxyphenyl)benzoic acid
InChI:
InChI=1S/C21H18O3/c1-15-13-18(21(22)23)9-12-20(15)17-7-10-19(11-8-17)24-14-16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,22,23)
InChI Key:
ASBXCSWWOJSHOV-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)C)c1ccc(cc1)OCc1ccccc1
Properties
Complexity:
394
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.126g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
318.372g/mol
Monoisotopic Mass:
318.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.