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820213-35-2 | Acetamide, N-[(3E)-4-(2-chlorophenyl)-4-phenyl-3-butenyl]-
CAS No: 820213-35-2 Catalog No: AG005E51 MDL No:
Product Description
Catalog Number:
AG005E51
Chemical Name:
Acetamide, N-[(3E)-4-(2-chlorophenyl)-4-phenyl-3-butenyl]-
CAS Number:
820213-35-2
Molecular Formula:
C18H18ClNO
Molecular Weight:
299.7946
IUPAC Name:
N-[4-(2-chlorophenyl)-4-phenylbut-3-enyl]acetamide
InChI:
InChI=1S/C18H18ClNO/c1-14(21)20-13-7-11-16(15-8-3-2-4-9-15)17-10-5-6-12-18(17)19/h2-6,8-12H,7,13H2,1H3,(H,20,21)
InChI Key:
ZBEQKOWWOJULLI-UHFFFAOYSA-N
SMILES:
CC(=O)NCC/C=C(/c1ccccc1Cl)\c1ccccc1
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.108g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
299.798g/mol
Monoisotopic Mass:
299.108g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.7
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