1,3-Propanediol, 2-(4-aminobutyl)-


Chemical Name: 1,3-Propanediol, 2-(4-aminobutyl)-
CAS Number: 125162-81-4
Product Number: AG000NA1(AGN-PC-0JMM5D)
Synonyms:
MDL No:
Molecular Formula: C7H17NO2
Molecular Weight: 147.2154

Identification/Properties


Computed Properties
Molecular Weight:
147.218g/mol
XLogP3:
-0.8
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
147.126g/mol
Monoisotopic Mass:
147.126g/mol
Topological Polar Surface Area:
66.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
64.6
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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