2-Benzothiazolyl N,N-dimethylcarbamodithioate
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Basic information
- CAS
3432-25-5- Standard SMILES
CN(C)C(=S)Sc1nc2ccccc2s1- InChIKey
DQXSUEZFMYQFSC-UHFFFAOYSA-N- Molecular formula
- C10H10N2S3
- Average molar mass
- 254.4 g/mol
- Monoisotopic mass
- 254.00061185
Names & identifiers
- Preferred name
- 2-Benzothiazolyl N,N-dimethylcarbamodithioate
- IUPAC
- 1,3-benzothiazol-2-yl N,N-dimethylcarbamodithioate
- English name
- Dimethyldithiocarbamic acid benzothiazole-2-yl ester
- Molecular weight
- 0
Names & synonyms
3432-25-52-Dimethyldithiocarbamyl benzothiazoleBenzothiazole, 2-dimethyldithiocarbamyl-FOO2R88VZUCARBAMIC ACID, DIMETHYLDITHIO-, 2-BENZOTHIAZOLYL ESTERNSC 652882-Dimethyl dithiocarbamyl benzothiazoleBRN 0196369Carbamodithioic acid, dimethyl-, 2-benzothiazolyl esterUNII-FOO2R88VZUNSC-652882-Benzothiazolyl N,N-dimethylcarbamodithioate
Show more names
1,3-Benzothiazol-2-yl N,N-dimethylcarbamodithioateDimethyldithiocarbamic acid benzothiazole-2-yl esterN,N-Dimethylcarbamodithioic acid benzothiazol-2-yl ester
DTXSID001878854-27-00-01851 (Beilstein Handbook Reference)CARBAMODITHIOIC ACID, N,N-DIMETHYL-, 2-BENZOTHIAZOLYL ESTERRefChem:85560DTXCID60110376Carbamodithioic acid, dimethyl-, 2-benzothiazolyl ester (9CI)USAF T-7benzo[d]thiazol-2-yl dimethylcarbamodithioate
Database identifiers
- CAS
3432-25-5- PubChem CID
- 18914
- DTXSID
DTXSID00187885- UNII
- FOO2R88VZU
- Nikkaji
- J42.887F
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 245
Physicochemical properties
- FDA UNII
- 2 R88VZU · FOO2R88VZU
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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