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2,2-Difluoropropan-1-amine

CAT: 0127-PC1004661-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-PC1004661-01Size:100 mg
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CAS Number
421-00-1
MDL Number
MFCD05864394
Purity
97%
Smiles
CC(F)(F)CN

Chemical Information

2,2-Difluoropropylamine hydrochloride
CAS Number421-00-1
PubChem CID2758355
IUPAC Name2,2-difluoropropan-1-amine;hydrochloride
Molecular FormulaC3H8ClF2N
Molecular Weight131.55
Topological Polar Surface Area26
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count7
Formal Charge0
Complexity44
SMILES
CC(CN)(F)F.Cl
InChI
InChI=1S/C3H7F2N.ClH/c1-3(4,5)2-6;/h2,6H2,1H3;1H
InChIKey
IDJKGOWDPKVIBR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,2-Difluoropropylamine hydrochloride
CAS: 421-00-1
CID: 2758355
Formula: C3H8ClF2N
MW: 131.55
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight131.55
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass131.0313333
Monoisotopic Mass131.0313333
Topological Polar Surface Area26 Ų
Heavy Atom Count7
Formal Charge0
Complexity44.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes