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18961-61-0 | 9-Octadecenamide, N-butyl-, (9Z)-
CAS No: 18961-61-0 Catalog No: AG002DT2 MDL No:
Product Description
Catalog Number:
AG002DT2
Chemical Name:
9-Octadecenamide, N-butyl-, (9Z)-
CAS Number:
18961-61-0
Molecular Formula:
C22H43NO
Molecular Weight:
337.5829
IUPAC Name:
(Z)-N-butyloctadec-9-enamide
InChI:
InChI=1S/C22H43NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(24)23-21-6-4-2/h12-13H,3-11,14-21H2,1-2H3,(H,23,24)/b13-12-
InChI Key:
WLUWZVUXQSJMCW-SEYXRHQNSA-N
SMILES:
CCCCCCCC/C=C\CCCCCCCC(=O)NCCCC
EC Number:
242-701-6
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
337.334g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
337.592g/mol
Monoisotopic Mass:
337.334g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.3
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