2-Buten-1-one, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)-
Basic information
- CAS
35444-10-1- Standard SMILES
O=C(C=C(C(F)(F)Cl)C(F)(F)Cl)c1cccs1- InChIKey
CTAGHLPMGHMCQU-UHFFFAOYSA-N- Molecular formula
- C9H4Cl2F4OS
- Average molar mass
- 307.09 g/mol
- Monoisotopic mass
- 305.929604
Names & identifiers
- Preferred name
- 2-Buten-1-one, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)-
- IUPAC
- 4-chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-1-thiophen-2-ylbut-2-en-1-one
Names & synonyms
NSC 1601762-BUTEN-1-ONE, 4-CHLORO-3-CHLORODIFLUOROMETHYL-4,4-DIFLUORO-1-(2-THIENYL)-35444-10-1DTXSID101889444-Chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)-2-buten-1-oneRefChem:257872DTXCID70111435NSC160176NSC-160176DS-0149392-Buten-1-one,4-difluoro-1-(2-thienyl)-4-chloro-3-(chloro-difluoro-methyl)-4,4-difluoro-1-thiophen-2-yl-but-2-en-1-one
Show more names
4-Chloro-3-[chlorodi(fluoro)methyl]-4,4-difluoro-1-(thiophen-2-yl)but-2-en-1-one
Database identifiers
- CAS
35444-10-1- PubChem CID
- 37146
- DTXSID
DTXSID10188944- Nikkaji
- J65.761A
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 330
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…