(3,4-Dichlorophenyl)methyl (3,4-dimethylphenyl)carbamodithioate
Basic information
- CAS
69243-64-7- Standard SMILES
Cc1ccc(NC(=S)SCc2ccc(Cl)c(Cl)c2)cc1C- InChIKey
HHZRVOYYHLMNDX-UHFFFAOYSA-N- Molecular formula
- C16H15Cl2NS2
- Average molar mass
- 356.3 g/mol
- Monoisotopic mass
- 355.0022972
Names & identifiers
- Preferred name
- (3,4-Dichlorophenyl)methyl (3,4-dimethylphenyl)carbamodithioate
- IUPAC
- (3,4-dichlorophenyl)methyl N-(3,4-dimethylphenyl)carbamodithioate
Names & synonyms
NSC29072369243-64-7DTXSID70398365(3,4-Dichlorophenyl)methyl (3,4-dimethylphenyl)carbamodithioate(3,4-dichlorophenyl)methyl N-(3,4-dimethylphenyl)carbamodithioateNSC-2907233,4-Dichlorobenzyl (3,4-dimethylphenyl)dithiocarbamate
Database identifiers
- CAS
69243-64-7- PubChem CID
- 3980207
- DTXSID
DTXSID70398365
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 69.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 353
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Compound notes
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