Consensus flow list

[2-(2-methoxymethylethoxy)methylethoxy]propanol

fo-b74a638c8faa0769

Identity

Type
Neutral molecule
CAS
25498-49-1
EC
247-045-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
53 across every transformer

Structure

Structure diagram for [2-(2-methoxymethylethoxy)methylethoxy]propanol

This substance carries 3 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.

Alternative labels

9

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string GVZNXUAPPLHUOM-UHFFFAOYSA-N, HPFDGTFXAVIVTH-UHFFFAOYSA-N, WAEVWDZKMBQDEJ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C10H22O4/c1-8(11)5-13-10(3)7-14-9(2)6-12-4/h8-11H,5-7H2,1-4H3, InChI=1S/C10H22O4/c1-8(5-11)13-7-10(3)14-6-9(2)12-4/h8-11H,5-7H2,1-4H3, InChI=1S/C10H22O4/c1-8(5-11)14-10(3)7-13-9(2)6-12-4/h8-11H,5-7H2,1-4H3
IUPAC name chemrof:IUPAC_name 1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]-2-propanol, 1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol, 1-[2-(2-methoxy-1-methyl-ethoxy)-1-methyl-ethoxy]propan-2-ol, 2-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]-1-propanol, 2-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-1-ol, 2-[2-(2-methoxy-1-methyl-ethoxy)-1-methyl-ethoxy]propan-1-ol, 2-[2-(2-methoxypropoxy)propoxy]-1-propanol, 2-[2-(2-methoxypropoxy)propoxy]propan-1-ol
Molecular formula chemrof:molecular_formula C10H22O4
SMILES string chemrof:smiles_string CC(CO)OC(C)COC(C)COC, CC(CO)OCC(C)OCC(C)OC, CC(COC(C)COC(C)COC)O

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=25498-49-1 enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:183311 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.039.743 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.042.754 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.125.113 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1751 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6021616 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID80274025 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3183760 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/20V3X25LZO enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/JOX71DM26J enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J101.712H enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J35.481C enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/25054 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/30111 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/33023 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27281615 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q27896602 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q81977418 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
a946b39a-d909-417c-bec8-0e0a595ca7d4 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
549b7f6e-c720-48e5-ac3b-db9d62b5a9b2 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
0c19a5c4-5cdd-44a7-a189-af22960996b1 Environmental → Air → Indoor EF 3.1 kg 4
6638e46e-8456-49cc-bb31-80c1a3103ace Environmental → Air → Long-term EF 3.1 kg 0
abdf4687-010b-4f49-9f25-f2b1a906446e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
817252e5-0b7c-49bf-bc23-930b230814cd Environmental → Air → Unknown EF 3.1 kg 4
10200f1c-d8fa-4a01-9e4e-02d2e9f081df Environmental → Ground → Agricultural EF 3.1 kg 4
82cdec9f-7c53-40c6-8501-5d80d2993146 Environmental → Ground → Non-agricultural EF 3.1 kg 4
6594f351-963a-448a-8ded-6cfa15423d5a Environmental → Ground → Unknown EF 3.1 kg 4
ed2c3a98-f3f9-4983-85a5-974f457f0493 Environmental → Water → Long-term EF 3.1 kg 0
2e71bc6c-1121-44ea-a833-c9c33dbc6772 Environmental → Water → Ocean EF 3.1 kg 4
91f0d469-cb3e-45c3-a35e-d1566ac26c69 Environmental → Water → Surface water EF 3.1 kg 4
ef93fd9d-b535-405e-bd54-2f551c7a5697 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (53 changes)

Open the changes page

Full record

Flow object JSON 
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