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824395-56-4 | 3,9-Octadecadien-2-ol, 1-amino-
CAS No: 824395-56-4 Catalog No: AG0051KV MDL No:
Product Description
Catalog Number:
AG0051KV
Chemical Name:
3,9-Octadecadien-2-ol, 1-amino-
CAS Number:
824395-56-4
Molecular Formula:
C18H35NO
Molecular Weight:
281.4766
IUPAC Name:
1-aminooctadeca-3,9-dien-2-ol
InChI:
InChI=1S/C18H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(20)17-19/h9-10,15-16,18,20H,2-8,11-14,17,19H2,1H3
InChI Key:
PXWJWZXYPFMLTD-UHFFFAOYSA-N
SMILES:
CCCCCCCCC=CCCCCC=CC(CN)O
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.272g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
281.484g/mol
Monoisotopic Mass:
281.272g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
2
XLogP3:
5.5
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