2,5-dimethylhexane-2,5-diol

1,1,4,4-Tetramethyl-1,4-butanediol
2,5-Dihydroxy-2,5-dimethylhexane
2,5-Dimethyl-2,5-dihydroxyhexane
2,5-Dimethyl-2,5-hexanediol
2,5-Hexanediol, 2,5-dimethyl-
Dimethyl Hexanediol

Property	Value
InChI2D key string chemrof:inchi2d_key_string	ZWNMRZQYWRLGMM-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C8H18O2/c1-7(2,9)5-6-8(3,4)10/h9-10H,5-6H2,1-4H3
IUPAC name chemrof:IUPAC_name	2,5-dimethylhexane-2,5-diol
Molecular formula chemrof:molecular_formula	C8H18O2
Molecular mass chemrof:molecular_mass	146.23
Monoisotopic mass chemrof:monoisotopic_mass	146.13068
SMILES string chemrof:smiles_string	CC(C)(O)CCC(C)(C)O

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=110-03-2	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.003.393	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID0026830	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=5595	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1476371	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/3PNB2S8721	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J126.489C	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/8031	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q8487586	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
f893459e-6225-479b-968f-84ca354955a1	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
bd41c50e-ac98-46d3-8f5e-faab9245472d	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
5f991a9a-8060-4bf4-9c08-a96b5ac76d12	Environmental → Air → Indoor	EF 3.1	kg	2
70105479-00e6-49c0-aa41-00a545d0223d	Environmental → Air → Long-term	EF 3.1	kg	0
b7b9928a-383d-493b-98e0-70622049d3d9	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
9ee74975-f1f4-4804-828d-9ee150b8620c	Environmental → Air → Unknown	EF 3.1	kg	2
f680e83f-3426-4304-b143-de07729e5c42	Environmental → Ground → Agricultural	EF 3.1	kg	2
e7c2805f-97f4-4cd6-97f6-000822a781de	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
140b42da-9b2a-4b70-891d-8a1f91cab249	Environmental → Ground → Unknown	EF 3.1	kg	2
8d44cf00-b88d-42c7-9499-168f7905d1a6	Environmental → Water → Long-term	EF 3.1	kg	0
aacba61d-bad4-4ef0-ae57-46a57ecd4167	Environmental → Water → Ocean	EF 3.1	kg	2
bf4bfd29-8328-4c7b-9e0a-ac584b462a60	Environmental → Water → Surface water	EF 3.1	kg	2
890418c0-a8fd-4a46-a28a-df7e863e0193	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (54 changes)

Open the changes page

Flow object JSON

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2,5-dimethylhexane-2,5-diol

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

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