Home Nitriles 2-cyclopropylpropanenitrile

2-cyclopropylpropanenitrile

CAS No.:
1096868-18-6
Catalog Number:
AG01A4OY
Molecular Formula:
C6H9N
Molecular Weight:
95.1424
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Product Description
Catalog Number:
AG01A4OY
Chemical Name:
2-cyclopropylpropanenitrile
CAS Number:
1096868-18-6
Molecular Formula:
C6H9N
Molecular Weight:
95.1424
MDL Number:
MFCD11641456
IUPAC Name:
2-cyclopropylpropanenitrile
InChI:
InChI=1S/C6H9N/c1-5(4-7)6-2-3-6/h5-6H,2-3H2,1H3
InChI Key:
XIXPBVLOLRFPNE-UHFFFAOYSA-N
SMILES:
CC(C1CC1)C#N
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
95.073g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
95.145g/mol
Monoisotopic Mass:
95.073g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties