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27330-47-8 | 4,5-Dimethylisothiazole
CAS No: 27330-47-8 Catalog No: AG00BR1Y MDL No:
Product Description
Catalog Number:
AG00BR1Y
Chemical Name:
4,5-Dimethylisothiazole
CAS Number:
27330-47-8
IUPAC Name:
4,5-dimethyl-1,2-thiazole
InChI:
InChI=1S/C5H7NS/c1-4-3-6-7-5(4)2/h3H,1-2H3
InChI Key:
SPRVGONRQZESPA-UHFFFAOYSA-N
Properties
Complexity:
65.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.03g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
113.178g/mol
Monoisotopic Mass:
113.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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