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85712-16-9

85712-16-9 | 9-Octadecenamide,N-(2-aminoethyl)-

CAS No: 85712-16-9 Catalog No: AG004POY MDL No:

Product Description

Catalog Number:
AG004POY
Chemical Name:
9-Octadecenamide,N-(2-aminoethyl)-
CAS Number:
85712-16-9
Molecular Formula:
C20H40N2O
Molecular Weight:
324.5444
IUPAC Name:
(E)-N-(2-aminoethyl)octadec-9-enamide
InChI:
InChI=1S/C20H40N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)22-19-18-21/h9-10H,2-8,11-19,21H2,1H3,(H,22,23)/b10-9+
InChI Key:
NEAVWSTWAPWAPP-MDZDMXLPSA-N
SMILES:
CCCCCCCCC=CCCCCCCCC(=O)NCCN
EC Number:
288-375-9

Properties

Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
324.314g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
324.553g/mol
Monoisotopic Mass:
324.314g/mol
Rotatable Bond Count:
17  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1  

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