2-methyl-3-methoxy Benzoyl Chloride
fo-18a0a59d9bb5be1c
Identity
- Type
- Neutral molecule
- CAS
- 24487-91-0
- EC
- 427-440-1
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
5- 2-Methyl-3-methoxybenzoyl chloride
- 2-Methyl-m-anisoyl chloride
- 3-Methoxy-2-methylbenzoyl chloride
- Benzoyl chloride, 3-methoxy-2-methyl-
- m-Anisoyl chloride, 2-methyl-
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | BXKZGIVKHPCDFO-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C9H9ClO2/c1-6-7(9(10)11)4-3-5-8(6)12-2/h3-5H,1-2H3 |
| IUPAC name chemrof:IUPAC_name | 2-methyl-3-methoxy Benzoyl Chloride |
| Molecular formula chemrof:molecular_formula | C9H9ClO2 |
| Molecular mass chemrof:molecular_mass | 184.622 |
| Monoisotopic mass chemrof:monoisotopic_mass | 184.029107 |
| SMILES string chemrof:smiles_string | COc1cccc(C(=O)Cl)c1C |
Known URLs
6Where 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=24487-91-0 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.114.510 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID10885269 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.782.116K | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/14719554 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q72492556 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| e89d5d76-fbd6-467f-8a19-037e27ec15df | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 1ffbd6c3-ed80-47a8-82d8-0e8bfc513917 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| de85a133-b178-4acb-8e04-3b12c8f68dc0 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| e68e0502-3035-4904-8279-699beb4ff5b7 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 397839bd-7813-49e3-8218-7c53f91102e1 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| d06ac37d-9fa1-4e7e-a8a0-259195181fb3 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 14ec94f9-9f17-48e3-a1f2-756c9b38c730 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 92292388-b7cb-4caa-95a4-993bab5c95c2 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 5f436342-eb80-4d23-a88c-3add4ddd4288 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 73778834-7ce6-487b-8ce3-222fa2e7153c | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| d3c8af9a-6dc9-451c-84d6-e7af0b782a91 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| f094c948-3086-4191-9b20-022022e35392 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 552efb1d-a508-46dd-8be7-2cab38eb536f | 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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- This is not that chemical
- This record is two substances, or it is a second copy of one
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