Home Nitriles 5-Nitrothiophene-3-carbonitrile

5-Nitrothiophene-3-carbonitrile

CAS No.:
42137-23-5
Catalog Number:
AG003HTA
Molecular Formula:
C5H2N2O2S
Molecular Weight:
154.1466
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$230
- +
Product Description
Catalog Number:
AG003HTA
Chemical Name:
5-Nitrothiophene-3-carbonitrile
CAS Number:
42137-23-5
Molecular Formula:
C5H2N2O2S
Molecular Weight:
154.1466
MDL Number:
MFCD00052580
IUPAC Name:
5-nitrothiophene-3-carbonitrile
InChI:
InChI=1S/C5H2N2O2S/c6-2-4-1-5(7(8)9)10-3-4/h1,3H
InChI Key:
NACMZLGGHMPMKQ-UHFFFAOYSA-N
SMILES:
N#Cc1csc(c1)[N+](=O)[O-]
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.984g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.143g/mol
Monoisotopic Mass:
153.984g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
97.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties