1,3-Propanediol, 2-amino-2-(hydroxymethyl)-


Chemical Name: 1,3-Propanediol, 2-amino-2-(hydroxymethyl)-
CAS Number: 77-86-1
Product Number: AG00397K(AGN-PC-00UN1M)
Synonyms:
MDL No:
Molecular Formula: C4H11NO3
Molecular Weight: 121.1350

Identification/Properties


Computed Properties
Molecular Weight:
121.136g/mol
XLogP3:
-2.9
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
121.074g/mol
Monoisotopic Mass:
121.074g/mol
Topological Polar Surface Area:
86.7A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
54
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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