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828252-53-5 | 1-Cyclohexene-1-acetamide, N-[(1S)-1-phenylethyl]-
CAS No: 828252-53-5 Catalog No: AG00568U MDL No:
Product Description
Catalog Number:
AG00568U
Chemical Name:
1-Cyclohexene-1-acetamide, N-[(1S)-1-phenylethyl]-
CAS Number:
828252-53-5
Molecular Formula:
C16H21NO
Molecular Weight:
243.3440
IUPAC Name:
2-(cyclohexen-1-yl)-N-[(1S)-1-phenylethyl]acetamide
InChI:
InChI=1S/C16H21NO/c1-13(15-10-6-3-7-11-15)17-16(18)12-14-8-4-2-5-9-14/h3,6-8,10-11,13H,2,4-5,9,12H2,1H3,(H,17,18)/t13-/m0/s1
InChI Key:
ZZABACABEZAFSK-ZDUSSCGKSA-N
SMILES:
O=C(N[C@H](c1ccccc1)C)CC1=CCCCC1
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
243.162g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.35g/mol
Monoisotopic Mass:
243.162g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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