Home Halogens 4,5-dichlorothiophene-3-carbonitrile

4,5-dichlorothiophene-3-carbonitrile

CAS No.:
1510984-04-9
Catalog Number:
AG01BE9K
Molecular Formula:
C5HCl2NS
Molecular Weight:
178.0391
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Product Description
Catalog Number:
AG01BE9K
Chemical Name:
4,5-dichlorothiophene-3-carbonitrile
CAS Number:
1510984-04-9
Molecular Formula:
C5HCl2NS
Molecular Weight:
178.0391
MDL Number:
MFCD26595890
IUPAC Name:
4,5-dichlorothiophene-3-carbonitrile
InChI:
InChI=1S/C5HCl2NS/c6-4-3(1-8)2-9-5(4)7/h2H
InChI Key:
GLUMTSGBCKJDHN-UHFFFAOYSA-N
SMILES:
N#Cc1csc(c1Cl)Cl
Properties
Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.921g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.03g/mol
Monoisotopic Mass:
176.921g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties