Consensus flow list

4-Methoxybenzyl alcohol

fo-acc76c821bf6f0a8

Identity

Type
Neutral molecule
CAS
105-13-5
EC
203-273-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 4-Methoxybenzyl alcohol

Alternative labels

15

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string MSHFRERJPWKJFX-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H10O2/c1-10-8-4-2-7(6-9)3-5-8/h2-5,9H,6H2,1H3
IUPAC name chemrof:IUPAC_name 4-Methoxybenzyl alcohol
Molecular formula chemrof:molecular_formula C8H10O2
Molecular mass chemrof:molecular_mass 138.166
Monoisotopic mass chemrof:monoisotopic_mass 138.06808
SMILES string chemrof:smiles_string COc1ccc(CO)cc1

Known URLs

19

Where 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=105-13-5 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=1331-81-3 enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:193647 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.002.976 enrich_references.pubchem_identifier_url
ChemSpider https://www.chemspider.com/Chemical-Structure.21105859.html enrich_references.chebi_xrefs
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6044357 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=2151 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL294431 enrich_references.pubchem_identifier_url
femaflavor.org https://www.femaflavor.org/flavor-library/anisyl-alcohol enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/7N6XGV3U49 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0034241 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.028B enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/D77792 enrich_references.chebi_xrefs
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=46442 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/7738 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=574484 enrich_references.pubchem_identifier_url
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/1424668 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q548873 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Anisyl_alcohol enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
f834c6e8-3a6b-44a2-a629-13f76274c007 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
ed69cd64-83f8-4951-b555-b24f4d00b4a9 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
273d4df4-6b1d-47ac-8a33-f52edca28d93 Environmental → Air → Indoor EF 3.1 kg 2
c86adea2-54c4-45b0-b8b7-f552c228550e Environmental → Air → Long-term EF 3.1 kg 0
bb8389ec-6d10-4a26-a72f-a9a1087031c7 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
77a01d8f-e863-4b12-bcd1-39e1b930261d Environmental → Air → Unknown EF 3.1 kg 2
4b5cd617-5131-4ecf-ad4e-e28cebe6fc37 Environmental → Ground → Agricultural EF 3.1 kg 2
729c4413-8b95-4b5f-b2d9-8d233ab11fa9 Environmental → Ground → Non-agricultural EF 3.1 kg 2
2bc74272-01b2-492f-8a2d-5eaca57edff6 Environmental → Ground → Unknown EF 3.1 kg 2
51c00b67-091e-4ec2-9802-2323fbe1ec06 Environmental → Water → Long-term EF 3.1 kg 0
fbaf308c-2f60-4b5f-bf9c-e43d24680d0b Environmental → Water → Ocean EF 3.1 kg 2
1c832584-0935-45e7-9303-0b56e336889f Environmental → Water → Surface water EF 3.1 kg 2
d02b6ad8-1996-46ba-80a3-1eb4186b71bc Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
{
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