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161137-64-0 | 4-Thiazolecarbonitrile, 5-(methylthio)-
CAS No: 161137-64-0 Catalog No: AG00B9DB MDL No:
Product Description
Catalog Number:
AG00B9DB
Chemical Name:
4-Thiazolecarbonitrile, 5-(methylthio)-
CAS Number:
161137-64-0
IUPAC Name:
5-methylsulfanyl-1,3-thiazole-4-carbonitrile
InChI:
InChI=1S/C5H4N2S2/c1-8-5-4(2-6)7-3-9-5/h3H,1H3
InChI Key:
BHYWASLLPBOBOS-UHFFFAOYSA-N
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.982g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.221g/mol
Monoisotopic Mass:
155.982g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
90.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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