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125353-44-8 | 2-Propanamine, 1,1,1-trifluoro-, hydrochloride (1:1), (2S)-
CAS No: 125353-44-8 Catalog No: AG000NIR MDL No:MFCD07779094
Product Description
Catalog Number:
AG000NIR
Chemical Name:
2-Propanamine, 1,1,1-trifluoro-, hydrochloride (1:1), (2S)-
CAS Number:
125353-44-8
Molecular Formula:
C3H7ClF3N
Molecular Weight:
149.5426
MDL Number:
MFCD07779094
IUPAC Name:
(2S)-1,1,1-trifluoropropan-2-amine;hydrochloride
InChI:
InChI=1S/C3H6F3N.ClH/c1-2(7)3(4,5)6;/h2H,7H2,1H3;1H/t2-;/m0./s1
InChI Key:
VLVCERQEOKPRTG-DKWTVANSSA-N
SMILES:
C[C@@H](C(F)(F)F)N.Cl
Properties
Complexity:
57.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
149.022g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
149.541g/mol
Monoisotopic Mass:
149.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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