Carbamic chloride, N-[5-(1,1-dimethylethyl)-1,3,4-thiadiazol-2-yl]-N-methyl-
Basic information
- CAS
106141-32-6- Standard SMILES
CN(C(=O)Cl)c1nnc(C(C)(C)C)s1- InChIKey
HBHLQGBZOYCPHE-UHFFFAOYSA-N- Molecular formula
- C8H12ClN3OS
- Average molar mass
- 233.72 g/mol
- Monoisotopic mass
- 233.0389609
Names & identifiers
- Preferred name
- Carbamic chloride, N-[5-(1,1-dimethylethyl)-1,3,4-thiadiazol-2-yl]-N-methyl-
- IUPAC
- N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-N-methylcarbamoyl chloride
Names & synonyms
Carbamic chloride, (5-(1,1-dimethylethyl)-1,3,4-thiadiazol-2-yl)methyl-DTXSID40888824(5-tert-Butyl-1,3,4-thiadiazol-2-yl)methylcarbamic chlorideCarbamic chloride, N-(5-(1,1-dimethylethyl)-1,3,4-thiadiazol-2-yl)-N-methyl-Carbamic chloride, N-[5-(1,1-dimethylethyl)-1,3,4-thiadiazol-2-yl]-N-methyl-[5-tert-Butyl-1,3,4-thiadiazol-2-yl]methylcarbamic chlorideRefChem:574057DTXCID901028098106141-32-6SCHEMBL27881665HBHLQGBZOYCPHE-UHFFFAOYSA-N(5-tert-Butyl-1,3,4-thiadiazol-2-yl)(methyl)carbamoyl chloride
Database identifiers
- CAS
106141-32-6- PubChem CID
- 3034962
- DTXSID
DTXSID40888824- Nikkaji
- J1.552.735H
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 74.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 231
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationCarbamic chloride, N-[5-(1,1-dimethylethyl)-1,3,4-thiadiazol-2-yl]-N-methyl-: INACTIVE
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Related reactions
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Compound notes
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