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204513-62-2 | Thiazole, 4-bromo-2-(methylthio)-
CAS No: 204513-62-2 Catalog No: AG0029K1 MDL No:MFCD07787376
Product Description
Catalog Number:
AG0029K1
Chemical Name:
Thiazole, 4-bromo-2-(methylthio)-
CAS Number:
204513-62-2
Molecular Formula:
C4H4BrNS2
Molecular Weight:
210.1153
MDL Number:
MFCD07787376
IUPAC Name:
4-bromo-2-methylsulfanyl-1,3-thiazole
InChI:
InChI=1S/C4H4BrNS2/c1-7-4-6-3(5)2-8-4/h2H,1H3
InChI Key:
YGCKEBOZMZSIDW-UHFFFAOYSA-N
SMILES:
CSc1nc(cs1)Br
Properties
Complexity:
80.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.897g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.107g/mol
Monoisotopic Mass:
208.897g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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