Home Halogens 2-(5-bromo-1,3-thiazol-4-yl)acetonitrile

2-(5-bromo-1,3-thiazol-4-yl)acetonitrile

CAS No.:
1909319-59-0
Catalog Number:
AG01APFU
Molecular Formula:
C5H3BrN2S
Molecular Weight:
203.0597
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Product Description
Catalog Number:
AG01APFU
Chemical Name:
2-(5-bromo-1,3-thiazol-4-yl)acetonitrile
CAS Number:
1909319-59-0
Molecular Formula:
C5H3BrN2S
Molecular Weight:
203.0597
MDL Number:
MFCD29762636
IUPAC Name:
2-(5-bromo-1,3-thiazol-4-yl)acetonitrile
InChI:
InChI=1S/C5H3BrN2S/c6-5-4(1-2-7)8-3-9-5/h3H,1H2
InChI Key:
DNQKRPSHCFXLJE-UHFFFAOYSA-N
SMILES:
Brc1scnc1CC#N
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.92g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.057g/mol
Monoisotopic Mass:
201.92g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties