Home Nitriles 3-Pyrrolidinecarbonitrile, 1-methyl-

3-Pyrrolidinecarbonitrile, 1-methyl-

CAS No.:
10603-50-6
Catalog Number:
AG0084HI
Molecular Formula:
C6H10N2
Molecular Weight:
110.1570
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Product Description
Catalog Number:
AG0084HI
Chemical Name:
3-Pyrrolidinecarbonitrile, 1-methyl-
CAS Number:
10603-50-6
Molecular Formula:
C6H10N2
Molecular Weight:
110.1570
MDL Number:
MFCD11227243
IUPAC Name:
1-methylpyrrolidine-3-carbonitrile
InChI:
InChI=1S/C6H10N2/c1-8-3-2-6(4-7)5-8/h6H,2-3,5H2,1H3
InChI Key:
QXYSYYCPALRMRV-UHFFFAOYSA-N
SMILES:
N#CC1CCN(C1)C
Properties
Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.084g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
110.16g/mol
Monoisotopic Mass:
110.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties