Basic information
- CAS
24197-66-8- Standard SMILES
Cc1ccc(SC(=O)CCl)cc1- InChIKey
PZCWLOADIZFERQ-UHFFFAOYSA-N- Molecular formula
- C9H9ClOS
- Average molar mass
- 200.69 g/mol
- Monoisotopic mass
- 200.0062638
Names & identifiers
- Preferred name
- S-Chloroacetyl-p-mercaptotoluene
- IUPAC
- S-(4-methylphenyl) 2-chloroethanethioate
- English name
- S-Chloroacetyl-p-mercaptotoluene
- Molecular formula
- C9H9ClOS
- Molecular weight
- 200.69
Names & synonyms
S-Chloroacetyl-p-mercaptotoluene24197-66-8DTXSID80304598RefChem:379513DTXCID00255730S-(4-methylphenyl) 2-chloroethanethioateNSC166433AKOS016010560NSC-166433S-(4-Methylphenyl) chloroethanethioateAC-22747DB-007861
Show more names
NSC 166433S-CHLOROACETYL-4-MERCAPTOTOLUENE2-Chloroethanethioic acid S-(4-methylphenyl) esterEthanethioic acid, 2-chloro-, S-(4-methylphenyl) ester
Database identifiers
- CAS
24197-66-8- PubChem CID
- 296348
- DTXSID
DTXSID80304598- Nikkaji
- J1.478.151J
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 153
Physicochemical properties
- Boiling point
- 291 ℃ · 291℃
- Density
- 1.24 · 1.24
- Flash point
- 130 ℃ · 130℃
Chemistry & industry
Suppliers11 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
AN PharmaTech Co Ltd86(21)68097365 · [email protected]
山东利腾生物科技有限公司15020019777 18663721413 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
重庆卡兰医药有限公司[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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