Home Nitriles 3-iodopropanenitrile

3-iodopropanenitrile

CAS No.:
2517-76-2
Catalog Number:
AG01B2GI
Molecular Formula:
C3H4IN
Molecular Weight:
180.9750
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Product Description
Catalog Number:
AG01B2GI
Chemical Name:
3-iodopropanenitrile
CAS Number:
2517-76-2
Molecular Formula:
C3H4IN
Molecular Weight:
180.9750
MDL Number:
MFCD18430837
IUPAC Name:
3-iodopropanenitrile
InChI:
InChI=1S/C3H4IN/c4-2-1-3-5/h1-2H2
InChI Key:
YYZBPKCINJVSGH-UHFFFAOYSA-N
SMILES:
ICCC#N
Properties
Complexity:
51.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.939g/mol
Formal Charge:
0
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.976g/mol
Monoisotopic Mass:
180.939g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties