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13633-89-1 | 2-Propenoic acid, [1,1'-biphenyl]-4-yl ester
CAS No: 13633-89-1 Catalog No: AG0011O8 MDL No:
Product Description
Catalog Number:
AG0011O8
Chemical Name:
2-Propenoic acid, [1,1'-biphenyl]-4-yl ester
CAS Number:
13633-89-1
Molecular Formula:
C15H12O2
Molecular Weight:
224.2546
IUPAC Name:
(4-phenylphenyl) prop-2-enoate
InChI:
InChI=1S/C15H12O2/c1-2-15(16)17-14-10-8-13(9-11-14)12-6-4-3-5-7-12/h2-11H,1H2
InChI Key:
LAOHSTYFUKBMQN-UHFFFAOYSA-N
SMILES:
C=CC(=O)Oc1ccc(cc1)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:
224.084g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.259g/mol
Monoisotopic Mass:
224.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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