Basic information
- CAS
924859-46-1- Standard SMILES
COC(=O)c1cc(S(=O)(=O)Cl)ccc1Cl- InChIKey
OCXSMSBPMSQANO-UHFFFAOYSA-N- Molecular formula
- C8H6Cl2O4S
- Average molar mass
- 269.1 g/mol
- Monoisotopic mass
- 267.9363852
Names & identifiers
- Preferred name
- Methyl 2-chloro-5-(chlorosulfonyl)benzoate
- IUPAC
- methyl 2-chloro-5-chlorosulfonylbenzoate
- English name
- 2-Chloro-5-chlorosulfonyl-benzoic acid methyl ester
- Molecular formula
- C8H6Cl2O4S
- Molecular weight
- 269.1
Names & synonyms
methyl 2-chloro-5-(chlorosulfonyl)benzoate924859-46-1RefChem:814297836-387-5methyl 2-chloro-5-chlorosulfonylbenzoateMFCD11057839SCHEMBL18547926GS3138AKOS002671088BS-33169methyl 2-chloro-5-chlorosulfonyl-benzoatemethyl2-chloro-5-(chlorosulfonyl)benzoate
Show more names
2-Chloro-5-chlorosulfonyl-benzoic acid methyl esterBenzoic acid, 2-chloro-5-(chlorosulfonyl)-, methyl ester
SY184451CS-0208245EN300-54853
Database identifiers
- CAS
924859-46-1- PubChem CID
- 43436734
- EC Number
- 836-387-5
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 68.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 335
Physicochemical properties
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H314
- Precautionary statements
- 280 · P280-P305+P351+P338-P310
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%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- Hazard statements
- H302-H314
- Precautionary statements
- P280-P305+P351+P338-P310
Chemistry & industry
Suppliers2 total
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
上海超岚化工科技中心（原上海巢莱）0-2022843681 15618226720 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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