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2296-14-2 | 1-Octanamine, N-octyl-, hydrochloride (1:1)
CAS No: 2296-14-2 Catalog No: AG002LP5 MDL No:
Product Description
Catalog Number:
AG002LP5
Chemical Name:
1-Octanamine, N-octyl-, hydrochloride (1:1)
CAS Number:
2296-14-2
Molecular Formula:
C16H36ClN
Molecular Weight:
277.9167
IUPAC Name:
N-octyloctan-1-amine;hydrochloride
InChI:
InChI=1S/C16H35N.ClH/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2;/h17H,3-16H2,1-2H3;1H
InChI Key:
AFQGAXFMOMNYDL-UHFFFAOYSA-N
SMILES:
CCCCCCCCNCCCCCCCC.Cl
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.254g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
277.921g/mol
Monoisotopic Mass:
277.254g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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