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6638-32-0 | 2,5,5-trimethyl-4,5-dihydro-1,3-thiazole
CAS No: 6638-32-0 Catalog No: AG006MCI MDL No:
Product Description
Catalog Number:
AG006MCI
Chemical Name:
2,5,5-trimethyl-4,5-dihydro-1,3-thiazole
CAS Number:
6638-32-0
Molecular Formula:
C6H11NS
Molecular Weight:
129.2232
IUPAC Name:
2,5,5-trimethyl-4H-1,3-thiazole
InChI:
InChI=1S/C6H11NS/c1-5-7-4-6(2,3)8-5/h4H2,1-3H3
InChI Key:
KPUBVYARPYJPPM-UHFFFAOYSA-N
SMILES:
CC1=NCC(S1)(C)C
NSC Number:
48046
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.061g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
129.221g/mol
Monoisotopic Mass:
129.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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