Home Halogens 3-bromo-5-methylthiophene-2-carbonitrile

3-bromo-5-methylthiophene-2-carbonitrile

CAS No.:
651034-29-6
Catalog Number:
AG01C5CG
Molecular Formula:
C6H4BrNS
Molecular Weight:
202.0717
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Product Description
Catalog Number:
AG01C5CG
Chemical Name:
3-bromo-5-methylthiophene-2-carbonitrile
CAS Number:
651034-29-6
Molecular Formula:
C6H4BrNS
Molecular Weight:
202.0717
MDL Number:
MFCD22058398
IUPAC Name:
3-bromo-5-methylthiophene-2-carbonitrile
InChI:
InChI=1S/C6H4BrNS/c1-4-2-5(7)6(3-8)9-4/h2H,1H3
InChI Key:
WONRKQFJBPVWRL-UHFFFAOYSA-N
SMILES:
N#Cc1sc(cc1Br)C
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.925g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.069g/mol
Monoisotopic Mass:
200.925g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties