1-Butanol, 3-amino-, (3S)-


Chemical Name: 1-Butanol, 3-amino-, (3S)-
CAS Number: 61477-39-2
Product Number: AG0038LO(AGN-PC-0ODE61)
Synonyms:
MDL No:
Molecular Formula: C4H11NO
Molecular Weight: 89.1362

Identification/Properties


Computed Properties
Molecular Weight:
89.138g/mol
XLogP3:
-0.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
89.084g/mol
Monoisotopic Mass:
89.084g/mol
Topological Polar Surface Area:
46.2A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
30.7
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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


GHS Pictogram:
Signal Word:
Danger
UN#:
2735
Hazard Statements:
H314-H318
Precautionary Statements:
P280-P301+P330+P331-P302+P352-P304+P340-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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