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88090-15-7 | 1-Octanamine, N-(4-chlorobutyl)-, hydrochloride
CAS No: 88090-15-7 Catalog No: AG004H2Q MDL No:
Product Description
Catalog Number:
AG004H2Q
Chemical Name:
1-Octanamine, N-(4-chlorobutyl)-, hydrochloride
CAS Number:
88090-15-7
Molecular Formula:
C12H27Cl2N
Molecular Weight:
256.2555
IUPAC Name:
N-(4-chlorobutyl)octan-1-amine;hydrochloride
InChI:
InChI=1S/C12H26ClN.ClH/c1-2-3-4-5-6-8-11-14-12-9-7-10-13;/h14H,2-12H2,1H3;1H
InChI Key:
ZKFFBMPDDVMSFH-UHFFFAOYSA-N
SMILES:
CCCCCCCCNCCCCCl.Cl
Properties
Complexity:
96.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.152g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
256.255g/mol
Monoisotopic Mass:
255.152g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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