2-hydroxy-m-anisaldehyde
fo-628197d2639e9dca
Identity
- Type
- Neutral molecule
- CAS
- 148-53-8
- EC
- 205-715-3
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
12- 2-hydroxy-3-methoxybenzaldehyde
- 2-Hydroxyl-3-methoxybenzaldehyde
- 2-Vanillin
- 3-Methoxy-2-hydroxybenzaldehyde
- 3-methoxysalicylaldehyde
- 6-Formyl-2-methoxyphenol
- 6-Formylguaiacol
- Benzaldehyde, 2-hydroxy-3-methoxy-
- m-Anisaldehyde, 2-hydroxy-
- o-Vaniline
- o-Vanillin
- Oxy-2 methoxy-3 benzaldehyde
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | JJVNINGBHGBWJH-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C8H8O3/c1-11-7-4-2-3-6(5-9)8(7)10/h2-5,10H,1H3 |
| IUPAC name chemrof:IUPAC_name | 2-hydroxy-m-anisaldehyde |
| Molecular formula chemrof:molecular_formula | C8H8O3 |
| Molecular mass chemrof:molecular_mass | 152.149 |
| Monoisotopic mass chemrof:monoisotopic_mass | 152.04734, 152.047344 |
| SMILES string chemrof:smiles_string | COc1cccc(C=O)c1O |
Known URLs
18Where 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=148-53-8 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:78339 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.005.197 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID5022011 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=2150 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL13859 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/008LR748FI | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J45.622E | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=123411 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/8991 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=521953 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/20292487 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22904806 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23625436 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/2671704 | enrich_references.chebi_xrefs |
| reaxys | reaxys:471913 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q309747 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Ortho-Vanillin | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 40db17d7-a40c-48dc-b452-91f1ba9ec1fd | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| f016c536-6f32-4090-8891-06919beb8df0 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 00d3757c-5f7d-441a-9025-6c1938d150d0 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 298ff571-a3c1-4dc1-a632-0a861adfd5f3 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 6c0e2afd-f1ec-483f-bcd0-6f08865e6798 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| b1bf47a1-a8fc-4a9f-8581-a50374a3aaab | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 7af3c16f-39a9-4003-ac50-02533596a783 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 85def328-00f3-4ee1-a06e-4e61e31218dd | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 88de5fa5-203d-46da-927c-6d646236da1a | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| d9bf2788-c6e9-450e-b34b-d835d70cbab4 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| ce17d98a-2920-456d-90b0-160988aa40e3 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| dde43223-9499-4262-ae82-9f6bb2b4c871 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 5525b135-d30c-445e-b0f9-2e71edf7e349 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
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