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2902-59-2 | Benzenepropanoic acid, α,α-diphenyl-, ethyl ester
CAS No: 2902-59-2 Catalog No: AG002V88 MDL No:
Product Description
Catalog Number:
AG002V88
Chemical Name:
Benzenepropanoic acid, α,α-diphenyl-, ethyl ester
CAS Number:
2902-59-2
Molecular Formula:
C23H22O2
Molecular Weight:
330.4196
IUPAC Name:
ethyl 2,2,3-triphenylpropanoate
InChI:
InChI=1S/C23H22O2/c1-2-25-22(24)23(20-14-8-4-9-15-20,21-16-10-5-11-17-21)18-19-12-6-3-7-13-19/h3-17H,2,18H2,1H3
InChI Key:
MNSMDJQFEBWHQU-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(c1ccccc1)(c1ccccc1)Cc1ccccc1
NSC Number:
75401
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.162g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.427g/mol
Monoisotopic Mass:
330.162g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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