Basic information
- CAS
540524-67-2- Standard SMILES
Cc1cccc(C)c1CS(=O)(=O)Cl- InChIKey
SLVJLZHMCFBLKO-UHFFFAOYSA-N- Molecular formula
- C9H11ClO2S
- Average molar mass
- 218.7 g/mol
- Monoisotopic mass
- 218.01682827
Names & identifiers
- Preferred name
- (2,6-dimethylphenyl)methanesulfonyl Chloride
- IUPAC
- (2,6-dimethylphenyl)methanesulfonyl chloride
- English name
- (2,6-Dimethylphenyl)methansulfonyl chloride
- Molecular formula
- C9H11ClO2S
- Molecular weight
- 218.7
Names & synonyms
(2,6-dimethylphenyl)methanesulfonyl Chloride540524-67-2DTXSID70459086RefChem:205653DTXCID70409905893-032-7(2,6-DIMETHYLPHENYL)METHANSULFONYL CHLORIDESCHEMBL1501035SLVJLZHMCFBLKO-UHFFFAOYSA-NQWA52467MFCD12403399AKOS006335681
Show more names
2,6-Dimethylbenzylsulfonyl chlorideBenzeneMethanesulfonyl chloride, 2,6-diMethyl-
SY503715(2,6-dimethylphenyl)methanesulfonylChloride2,6-dimethyl-Benzenemethanesulfonyl chlorideCS-0139463(2,6-dimethylphenyl)-methanesulfonyl chloride(2,6-dimethyl-phenyl)-methanesulfonic chlorideEN300-223495
Database identifiers
- CAS
540524-67-2- PubChem CID
- 11218255
- DTXSID
DTXSID70459086- EC Number
- 893-032-7
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 245
Physicochemical properties
- Boiling point
- 326 ℃ · 326℃
- Density
- 1.281 · 1.281
- Flash point
- 151 ℃ · 151℃
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers10 total
南通菡芳生物科技有限公司[email protected] 18017580634 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
上海景容化学科技有限公司021-60546673 13701861782 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海修时生物医药有限公司15002184385 15021598081 15002184385 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
7 records
Compound notes
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