MCPB-ethyl
fo-b7645ee3eae6046d
Identity
- Type
- Neutral molecule
- CAS
- 10443-70-6
- EC
- —
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 58 across every transformer
Structure
Alternative labels
9- Butanoic acid, 4-(4-chloro-2-methylphenoxy)-, ethyl ester
- Butyric acid, 4-[(4-chloro-o-tolyl)oxy]-, ethyl ester
- Ethyl (2-methyl-4-chlorophenoxy)butyrate
- Ethyl 4-(4-chloro-2-methylphenoxy)butyrate
- Ethyl 4-[(4-chloro-o-tolyl)oxy]butyrate
- Ethyl γ-(2-methyl-4-chlorophenoxy)butyrate
- MCPB ethyl
- MCPB ethyl ester
- MCPBE
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | XNKARWLGLZGMGX-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C13H17ClO3/c1-3-16-13(15)5-4-8-17-12-7-6-11(14)9-10(12)2/h6-7,9H,3-5,8H2,1-2H3 |
| IUPAC name chemrof:IUPAC_name | Butanoic acid, 4-(4-chloro-2-methylphenoxy)-, ethyl ester |
| Molecular formula chemrof:molecular_formula | C13H17ClO3 |
| Molecular mass chemrof:molecular_mass | 256.729 |
| Monoisotopic mass chemrof:monoisotopic_mass | 256.086622 |
| SMILES string chemrof:smiles_string | CCOC(=O)CCCOc1ccc(Cl)cc1C |
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=10443-70-6 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.123.876 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID4058287 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.226D | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/25286 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q81976794 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 4d7ee906-d568-4fe7-83af-b46929646911 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 55a1cb37-e9b8-4a63-bf76-32baabc744fc | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 3176bf90-97da-4f21-a1f4-7ff11701d90a | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 4b1df427-750c-48b1-b9c6-1902589082d4 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 3579186f-c6c8-47bd-ada9-51ec78861f5a | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 77c20f40-8335-4304-af12-23059b2debd6 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 00329712-7cd0-4466-968d-0372bf1c31e8 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 0784c6eb-61e9-4b2b-8e98-a0f30fea65b1 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 468a1a73-87c6-4727-a0c6-d9e198d83b14 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 92debeac-9a4e-455b-aa20-fa1aac010df5 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 6a107922-a883-41b7-b593-e53892632799 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 13cfee54-2e63-4af2-8cc0-045ba7668cf2 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 142e7d29-2b6d-4af2-9076-7300eff2b324 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (58 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