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74713-63-6 | Dodecanamide, N-[2-hydroxy-1-(hydroxymethyl)-3-heptadecenyl]-
CAS No: 74713-63-6 Catalog No: AG005HYA MDL No:
Product Description
Catalog Number:
AG005HYA
Chemical Name:
Dodecanamide, N-[2-hydroxy-1-(hydroxymethyl)-3-heptadecenyl]-
CAS Number:
74713-63-6
Molecular Formula:
C30H59NO3
Molecular Weight:
481.7944
IUPAC Name:
N-(1,3-dihydroxyoctadec-4-en-2-yl)dodecanamide
InChI:
InChI=1S/C30H59NO3/c1-3-5-7-9-11-13-14-15-16-18-19-21-23-25-29(33)28(27-32)31-30(34)26-24-22-20-17-12-10-8-6-4-2/h23,25,28-29,32-33H,3-22,24,26-27H2,1-2H3,(H,31,34)
InChI Key:
HXFPPRPLRSPNIB-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCC=CC(C(NC(=O)CCCCCCCCCCC)CO)O
Properties
Complexity:
452
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
481.449g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
481.806g/mol
Monoisotopic Mass:
481.449g/mol
Rotatable Bond Count:
26
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
10.7
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