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136723-75-6 | 2H-Pyrrol-2-one, 3-cyclopropyl-1,3-dihydro-1,5-dimethyl-3,4-diphenyl-
CAS No: 136723-75-6 Catalog No: AG0012A0 MDL No:
Product Description
Catalog Number:
AG0012A0
Chemical Name:
2H-Pyrrol-2-one, 3-cyclopropyl-1,3-dihydro-1,5-dimethyl-3,4-diphenyl-
CAS Number:
136723-75-6
Molecular Formula:
C21H21NO
Molecular Weight:
303.3975
IUPAC Name:
3-cyclopropyl-1,5-dimethyl-3,4-diphenylpyrrol-2-one
InChI:
InChI=1S/C21H21NO/c1-15-19(16-9-5-3-6-10-16)21(18-13-14-18,20(23)22(15)2)17-11-7-4-8-12-17/h3-12,18H,13-14H2,1-2H3
InChI Key:
KZUNVDPVSNAJGX-UHFFFAOYSA-N
SMILES:
CN1C(=C(C(C1=O)(C1CC1)c1ccccc1)c1ccccc1)C
Properties
Complexity:
506
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.162g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.405g/mol
Monoisotopic Mass:
303.162g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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