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Home > Fluorides > 1376176-56-5
1376176-56-5 | Pyrrolidine, 3-(difluoromethyl)-, hydrochloride (1:1)
CAS No: 1376176-56-5 Catalog No: AG0013MY MDL No:MFCD22196486
Product Description
Catalog Number:
AG0013MY
Chemical Name:
Pyrrolidine, 3-(difluoromethyl)-, hydrochloride (1:1)
CAS Number:
1376176-56-5
Molecular Formula:
C5H10ClF2N
Molecular Weight:
157.5894
MDL Number:
MFCD22196486
IUPAC Name:
3-(difluoromethyl)pyrrolidine;hydrochloride
InChI:
InChI=1S/C5H9F2N.ClH/c6-5(7)4-1-2-8-3-4;/h4-5,8H,1-3H2;1H
InChI Key:
KLYIIIVFEGRMJI-UHFFFAOYSA-N
SMILES:
FC(C1CNCC1)F.Cl
Properties
Complexity:
74.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.047g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
157.589g/mol
Monoisotopic Mass:
157.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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