2-Methyl-6-(2-methylprop-1-enyl)-1,3-benzothiazole
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Basic information
- CAS
88613-64-3- Standard SMILES
CC(C)=Cc1ccc2nc(C)sc2c1- InChIKey
MYFYLLYFXCBPHB-UHFFFAOYSA-N- Molecular formula
- C12H13NS
- Average molar mass
- 203.31 g/mol
Names & identifiers
- Preferred name
- 2-Methyl-6-(2-methylprop-1-enyl)-1,3-benzothiazole
- IUPAC
- 2-methyl-6-(2-methylprop-1-enyl)-1,3-benzothiazole
- English name
- Benzothiazole, 2-methyl-6-(2-methylpropenyl)- (7CI)
- Molecular formula
- C12H13NS
- Molecular weight
- 203.3
Names & synonyms
88613-64-3DB-285892BENZOTHIAZOLE, 2-METHYL-6-(2-METHYLPROPENYL)-Benzothiazole, 2-methyl-6-(2-methyl-1-propen-1-yl)-Benzothiazole, 2-methyl-6-(2-methylpropenyl)- (7CI)
Database identifiers
- CAS
88613-64-3
Properties
Computed structural propertiesFilling in
- XLogP
- 4.4
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
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Compound notes
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