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Home > Fluorides > 1394041-81-6
1394041-81-6 | Azetidine, 3-(2,2,2-trifluoroethyl)-, hydrochloride (1:1)
CAS No: 1394041-81-6 Catalog No: AG001AY7 MDL No:MFCD22375347
Product Description
Catalog Number:
AG001AY7
Chemical Name:
Azetidine, 3-(2,2,2-trifluoroethyl)-, hydrochloride (1:1)
CAS Number:
1394041-81-6
Molecular Formula:
C5H9ClF3N
Molecular Weight:
175.5799
MDL Number:
MFCD22375347
IUPAC Name:
3-(2,2,2-trifluoroethyl)azetidine;hydrochloride
InChI:
InChI=1S/C5H8F3N.ClH/c6-5(7,8)1-4-2-9-3-4;/h4,9H,1-3H2;1H
InChI Key:
ODBDUZZXMPFLTD-UHFFFAOYSA-N
SMILES:
FC(CC1CNC1)(F)F.Cl
Properties
Complexity:
94.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.038g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
175.579g/mol
Monoisotopic Mass:
175.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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