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108666-14-4 | Thiazole, 2,3-dihydro-2-(1-methoxyethylidene)-3,4-dimethyl-
CAS No: 108666-14-4 Catalog No: AG0083DF MDL No:
Product Description
Catalog Number:
AG0083DF
Chemical Name:
Thiazole, 2,3-dihydro-2-(1-methoxyethylidene)-3,4-dimethyl-
CAS Number:
108666-14-4
Molecular Formula:
C8H13NOS
Molecular Weight:
171.2599
IUPAC Name:
2-(1-methoxyethylidene)-3,4-dimethyl-1,3-thiazole
InChI:
InChI=1S/C8H13NOS/c1-6-5-11-8(9(6)3)7(2)10-4/h5H,1-4H3
InChI Key:
WWQVQLUWKHLVOD-UHFFFAOYSA-N
SMILES:
COC(=c1scc(n1C)C)C
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.072g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.258g/mol
Monoisotopic Mass:
171.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.8
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