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87116-71-0 | Thiazole,4-methyl-2,5-dipropyl-
CAS No: 87116-71-0 Catalog No: AG004TWA MDL No:
Product Description
Catalog Number:
AG004TWA
Chemical Name:
Thiazole,4-methyl-2,5-dipropyl-
CAS Number:
87116-71-0
Molecular Formula:
C10H17NS
Molecular Weight:
183.3137
IUPAC Name:
4-methyl-2,5-dipropyl-1,3-thiazole
InChI:
InChI=1S/C10H17NS/c1-4-6-9-8(3)11-10(12-9)7-5-2/h4-7H2,1-3H3
InChI Key:
VAEQRSTWJQPJLA-UHFFFAOYSA-N
SMILES:
CCCc1sc(c(n1)C)CCC
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.108g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.313g/mol
Monoisotopic Mass:
183.108g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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