3,6-dimethylheptan-2-ol

2-Heptanol, 3,6-dimethyl-
3,6-Dimethyl-2-heptanol
Terpirosa

Property	Value
InChI2D key string chemrof:inchi2d_key_string	NTDKHABICKZMPG-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C9H20O/c1-7(2)5-6-8(3)9(4)10/h7-10H,5-6H2,1-4H3
IUPAC name chemrof:IUPAC_name	3,6-dimethylheptan-2-ol
Molecular formula chemrof:molecular_formula	C9H20O
Molecular mass chemrof:molecular_mass	144.258
Monoisotopic mass chemrof:monoisotopic_mass	144.151415
SMILES string chemrof:smiles_string	CC(C)CCC(C)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=1247790-47-1	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.228.590	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID90889280	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.745.672A	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/19871663	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q82869122	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
0db65911-3053-4341-a220-79aa4332d194	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
ac940619-1505-470f-9b17-c9bbc45a5f98	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
751384b3-955e-4219-9f93-6350dca3ddb1	Environmental → Air → Indoor	EF 3.1	kg	2
c6b6c73a-a31a-48c9-835e-ab6bae5c3901	Environmental → Air → Long-term	EF 3.1	kg	0
b15b5f01-ca69-410e-b927-35bdfa79d82f	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
ee034774-09ff-4ec5-8494-39e95c30dabd	Environmental → Air → Unknown	EF 3.1	kg	2
23420b31-f014-40fd-946e-e7d2041d5b97	Environmental → Ground → Agricultural	EF 3.1	kg	2
1d3bbd57-c9a1-4954-b555-45d22fbd0a0f	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
4039ceb9-560a-4483-b354-46cb292fbfd5	Environmental → Ground → Unknown	EF 3.1	kg	2
03a082eb-76d5-49af-ac25-35e26b9e046a	Environmental → Water → Long-term	EF 3.1	kg	0
e902c06b-f216-4535-a61c-3d852fc53edc	Environmental → Water → Ocean	EF 3.1	kg	2
3488f4b9-16a3-48a3-878e-0a85b18c4abb	Environmental → Water → Surface water	EF 3.1	kg	2
6e0f4c1c-7139-4edd-931f-937d0e1532f8	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (53 changes)

Open the changes page

Flow object JSON

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3,6-dimethylheptan-2-ol

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

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