Home Nitriles 3-fluoropyrrolidine-3-carbonitrile hydrochloride

3-fluoropyrrolidine-3-carbonitrile hydrochloride

CAS No.:
1363405-64-4
Catalog Number:
AG00HULI
Molecular Formula:
C5H8ClFN2
Molecular Weight:
150.5818
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Product Description
Catalog Number:
AG00HULI
Chemical Name:
3-fluoropyrrolidine-3-carbonitrile hydrochloride
CAS Number:
1363405-64-4
Molecular Formula:
C5H8ClFN2
Molecular Weight:
150.5818
MDL Number:
MFCD21607329
IUPAC Name:
3-fluoropyrrolidine-3-carbonitrile;hydrochloride
InChI:
InChI=1S/C5H7FN2.ClH/c6-5(3-7)1-2-8-4-5;/h8H,1-2,4H2;1H
InChI Key:
IHTAJUCUSXGKMD-UHFFFAOYSA-N
SMILES:
N#CC1(F)CNCC1.Cl
Properties
Complexity:
137  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.036g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
150.581g/mol
Monoisotopic Mass:
150.036g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties