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1375069-02-5 | [1,1'-Biphenyl]-3-acetic acid, 2'-methyl-
CAS No: 1375069-02-5 Catalog No: AG0013FY MDL No:MFCD05981056
Product Description
Catalog Number:
AG0013FY
Chemical Name:
[1,1'-Biphenyl]-3-acetic acid, 2'-methyl-
CAS Number:
1375069-02-5
Molecular Formula:
C15H14O2
Molecular Weight:
226.2705
MDL Number:
MFCD05981056
IUPAC Name:
2-[3-(2-methylphenyl)phenyl]acetic acid
InChI:
InChI=1S/C15H14O2/c1-11-5-2-3-8-14(11)13-7-4-6-12(9-13)10-15(16)17/h2-9H,10H2,1H3,(H,16,17)
InChI Key:
MBCVVFMOLIMBHJ-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cccc(c1)c1ccccc1C
Properties
Complexity:
262
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:
3
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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