Home Sulfos 2-(cyclopropanesulfonyl)acetonitrile

2-(cyclopropanesulfonyl)acetonitrile

CAS No.:
1349716-02-4
Catalog Number:
AG01B1G8
Molecular Formula:
C5H7NO2S
Molecular Weight:
145.1796
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Product Description
Catalog Number:
AG01B1G8
Chemical Name:
2-(cyclopropanesulfonyl)acetonitrile
CAS Number:
1349716-02-4
Molecular Formula:
C5H7NO2S
Molecular Weight:
145.1796
MDL Number:
MFCD20233364
IUPAC Name:
2-cyclopropylsulfonylacetonitrile
InChI:
InChI=1S/C5H7NO2S/c6-3-4-9(7,8)5-1-2-5/h5H,1-2,4H2
InChI Key:
VCXXULKHKGKURQ-UHFFFAOYSA-N
SMILES:
N#CCS(=O)(=O)C1CC1
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.02g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.176g/mol
Monoisotopic Mass:
145.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties