Basic information
- CAS
83521-72-6- Standard SMILES
Clc1ccc(C2SCCS2)c(Cl)c1- InChIKey
UCYKMVSEQPLQBB-UHFFFAOYSA-N- Molecular formula
- C9H8Cl2S2
- Average molar mass
- 251.2 g/mol
- Monoisotopic mass
- 249.944448
Names & identifiers
- Preferred name
- 2-(2,4-Dichlorophenyl)-1,3-dithiolane
- IUPAC
- 2-(2,4-dichlorophenyl)-1,3-dithiolane
- English name
- 2-(2,4-dichlorophenyl)-1,3-dithiolane
- Molecular formula
- C9H8Cl2S2
- Molecular weight
- 251.19582
Names & synonyms
2-(2,4-Dichlorophenyl)-1,3-dithiolane83521-72-61,3-DITHIOLANE, 2-(2,4-DICHLOROPHENYL)-UB740Z7UXDNSC 202814BRN 0177045UNII-UB740Z7UXDNSC-202814DTXSID002324204-19-00-00209 (Beilstein Handbook Reference)RefChem:197535DTXCID00154911
Show more names
NSC202814AKOS024321213AL-182/11625015
Database identifiers
- CAS
83521-72-6- PubChem CID
- 55017
- DTXSID
DTXSID00232420- UNII
- UB740Z7UXD
- Nikkaji
- J91.147J
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 171
Physicochemical properties
- FDA UNII
- 740 Z7UXD · UB740Z7UXD
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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