Anethole
fo-2f5348d53c9a9bf8
Identity
- Type
- Neutral molecule
- CAS
- 104-46-1
- EC
- 203-205-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
23- 1-(4-Methoxyphenyl)-1-propene
- 1-Methoxy-4-(1-propen-1-yl)benzene
- 1-Methoxy-4-(1-propenyl)benzene
- 1-Methoxy-4-propenylbenzene
- 1-Propene, 1-(4-methoxyphenyl)-
- 4-(1-Propenyl)anisole
- 4-Methoxy-1-propenylbenzene
- 4-Methoxypropenylbenzene
- 4-Propenylanisole
- Anethol
- Anise camphor
- Anisole, p-propenyl-
- Benzene, 1-methoxy-4-(1-propen-1-yl)-
- Benzene, 1-methoxy-4-(1-propenyl)-
- Isoestragole
- methyl 4-(prop-1-en-1-yl)phenyl ether
- Nauli gum
- Oil of aniseed
- p-1-Propenylanisole
- p-Anethole
- p-Methoxy-β-methylstyrene
- p-propenylanisole
- p-Propenylphenyl methyl ether
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | RUVINXPYWBROJD-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3 |
| IUPAC name chemrof:IUPAC_name | Anethole |
| Molecular formula chemrof:molecular_formula | C10H12O |
| Molecular mass chemrof:molecular_mass | 148.205 |
| Monoisotopic mass chemrof:monoisotopic_mass | 148.088815, 148.08882 |
| SMILES string chemrof:smiles_string | CC=Cc1ccc(OC)cc1 |
Known URLs
5Where 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=104-46-1 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:2716 | enrich_references.chebi_id_link |
| lincs.smallmolecule | lincs.smallmolecule:LSM-37103 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/24689303 | enrich_references.chebi_xrefs |
| reaxys | reaxys:774229 | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 2d8cafe6-7d75-4a01-8ef4-10bfaf00e73b | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 0 |
| 268b83b8-f22b-4410-8fba-a8a2db4cd9f3 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 0 |
| 2d387a77-cc5b-4ff6-9310-324f8030d37f | Environmental → Air → Indoor | EF 3.1 | kg | 0 |
| 98e227c6-778e-4302-9439-4aaf396919f3 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 9157687d-4d2d-400d-b4f2-b28941344e19 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 0 |
| 4de0c4e8-5bce-4048-9194-88f319763af6 | Environmental → Air → Unknown | EF 3.1 | kg | 0 |
| 9bfb9099-e335-4a81-9901-c39804d407f6 | Environmental → Ground → Agricultural | EF 3.1 | kg | 0 |
| e5034303-c3b2-4fa1-9e83-92bcb41e21d6 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 0 |
| 0069ef12-110a-46c7-809d-7f0a1a47267e | Environmental → Ground → Unknown | EF 3.1 | kg | 0 |
| 8b67e364-1973-4549-a894-56813a602b5d | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| bc5b9cdf-64e8-4668-8404-5cb3c59984ee | Environmental → Water → Ocean | EF 3.1 | kg | 0 |
| 8048b307-845e-4a16-b16e-40d393c751f8 | Environmental → Water → Surface water | EF 3.1 | kg | 0 |
| e34b001e-0cea-49cf-9168-a7eab15d2242 | Environmental → Water → Unknown | EF 3.1 | kg | 0 |
History
Everything that changed this substance (56 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