4-methylbenzenesulfonyl Chloride
fo-d6e057860e4c7771
Identity
- Type
- Neutral molecule
- CAS
- 98-59-9
- EC
- 202-684-8
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
18- 4-Methylbenzene-1-sulfonyl chloride
- 4-Methylbenzenesulphonyl chloride
- 4-Methylphenylsulfonyl chloride
- 4-Toluenesulfonyl chloride
- 4-Toluolsulfonyl chloride
- 4-Tosyl chloride
- Benzenesulfonyl chloride, 4-methyl-
- p-Methylbenzenesulfonyl chloride
- p-Methylphenylsulfonyl chloride
- p-Toluenesulfochloride
- p-Toluenesulfonic acid chloride
- p-Toluenesulfonic chloride
- p-Toluenesulfonyl chloride
- p-Tolylsulfonyl chloride
- p-Tosyl chloride
- Toluenesulfonyl chloride
- TosCl
- Tosyl chloride
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | YYROPELSRYBVMQ-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C7H7ClO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3 |
| IUPAC name chemrof:IUPAC_name | 4-methylbenzenesulfonyl Chloride |
| Molecular formula chemrof:molecular_formula | C7H7ClO2S |
| Molecular mass chemrof:molecular_mass | 190.651 |
| Monoisotopic mass chemrof:monoisotopic_mass | 189.985528 |
| SMILES string chemrof:smiles_string | Cc1ccc(S(=O)(=O)Cl)cc1 |
Known URLs
11Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=98-59-9 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.002.441 | enrich_references.pubchem_identifier_url |
| chemicalsafety.ilo.org | https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1762 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID1052660 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=175822 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/027KYN78B4 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.580G | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/7397 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/erg/#1759 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q285621 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/4-Toluenesulfonyl_chloride | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 5e220732-06d9-46c6-8415-5393ddcd1281 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 80bff058-fc8e-4753-af8f-134caf2abac0 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| fd7ae181-5b65-4e77-971c-4b62f6e22e91 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 6fdf5388-ac0b-4035-9faa-e99fbf6b1883 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 7c0b8dc0-99a3-4ca7-83a0-28f5729e79e4 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 1cb9f125-4bb3-4049-9c25-8b4238e99609 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 97f88d36-d376-4755-9295-9ff845022852 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 12dea467-c74f-4dc4-9c02-8de98fdfe522 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 69d1e1a2-edad-4538-8344-ac693fac78d4 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| c6395783-6329-4160-ba8c-5d1f380e1007 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 3d43299b-a02b-4b99-8a6d-380576adb55e | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 65091c51-2e20-4ff3-ac1e-4a4e29dec6b3 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| b285ea57-38d1-4c4b-a48c-52205bb2f087 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (55 changes)
Full record
Flow object JSON
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Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works