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31075-49-7 | Ethanaminium, N,N,N-tris(hydroxymethyl)-
CAS No: 31075-49-7 Catalog No: AG00321U MDL No:
Product Description
Catalog Number:
AG00321U
Chemical Name:
Ethanaminium, N,N,N-tris(hydroxymethyl)-
CAS Number:
31075-49-7
Molecular Formula:
C5H14NO3+
Molecular Weight:
136.1696
IUPAC Name:
ethyl-tris(hydroxymethyl)azanium
InChI:
InChI=1S/C5H14NO3/c1-2-6(3-7,4-8)5-9/h7-9H,2-5H2,1H3/q+1
InChI Key:
JGAPOFXMHSOMPW-UHFFFAOYSA-N
SMILES:
CC[N+](CO)(CO)CO
Properties
Complexity:
64.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.097g/mol
Formal Charge:
1
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
136.171g/mol
Monoisotopic Mass:
136.097g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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