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101396-91-2 | 1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-trimethyl-, chloride (1:1), (2S)-
CAS No: 101396-91-2 Catalog No: AG0004E6 MDL No:
Product Description
Catalog Number:
AG0004E6
Chemical Name:
1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-trimethyl-, chloride (1:1), (2S)-
CAS Number:
101396-91-2
IUPAC Name:
[(2S)-3-chloro-2-hydroxypropyl]-trimethylazanium;chloride
InChI:
InChI=1S/C6H15ClNO.ClH/c1-8(2,3)5-6(9)4-7;/h6,9H,4-5H2,1-3H3;1H/q+1;/p-1/t6-;/m1./s1
InChI Key:
CSPHGSFZFWKVDL-FYZOBXCZSA-M
Properties
Complexity:
79.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
187.053g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.092g/mol
Monoisotopic Mass:
187.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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