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873544-89-9 | Cyclohexanecarboxylic acid, 1-[(1-oxohexadecyl)amino]-
CAS No: 873544-89-9 Catalog No: AG004KSB MDL No:
Product Description
Catalog Number:
AG004KSB
Chemical Name:
Cyclohexanecarboxylic acid, 1-[(1-oxohexadecyl)amino]-
CAS Number:
873544-89-9
Molecular Formula:
C23H43NO3
Molecular Weight:
381.5924
IUPAC Name:
1-(hexadecanoylamino)cyclohexane-1-carboxylic acid
InChI:
InChI=1S/C23H43NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-21(25)24-23(22(26)27)19-16-14-17-20-23/h2-20H2,1H3,(H,24,25)(H,26,27)
InChI Key:
DFOBICOJFDUNIT-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCC(=O)NC1(CCCCC1)C(=O)O
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.324g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
381.601g/mol
Monoisotopic Mass:
381.324g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.1
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