C(CNCC(F)(F)F)CCl
名称: 3-chloro-N-(2,2,2-trifluoroethyl)propan-1-amine
SMILES: C(CNCC(F)(F)F)CCl

Molecular Processing

Molecular formula
C5H9ClF3N
Molecular weight
175.58
Exact mass
175.0376
XLogP
1.77
TPSA
12.03
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
10
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
1
Molar refractivity
34.26

Supplementary Information

InChIKey: JLWHQBUVDYUJFD-UHFFFAOYSA-N
同義語
(3-chloropropyl)(2,2,2-trifluoroethyl)amineSCHEMBL16681134AKOS014359296
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