2-chloro-1,1-dimethoxyethane

1,1-Dimethoxy-2-chloroethane
1-Chloro-2,2-dimethoxyethane
2,2-Dimethoxyethyl chloride
2-Chloroacetaldehyde dimethyl acetal
Acetaldehyde, chloro-, dimethyl acetal
Chloroacetaldehyde dimethyl acetal
Ethane, 2-chloro-1,1-dimethoxy-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	CRZJPEIBPQWDGJ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C4H9ClO2/c1-6-4(3-5)7-2/h4H,3H2,1-2H3
IUPAC name chemrof:IUPAC_name	2-chloro-1,1-dimethoxyethane
Molecular formula chemrof:molecular_formula	C4H9ClO2
Molecular mass chemrof:molecular_mass	124.567
Monoisotopic mass chemrof:monoisotopic_mass	124.029107
SMILES string chemrof:smiles_string	COC(CCl)OC

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=97-97-2	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.002.386	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID1059157	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=60388	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/1KPA4H9T18	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J24.188A	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/60986	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q27252548	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
0b5973c8-7995-40b7-b193-d50b80921593	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
3404a05f-1405-42c4-a69c-abe7806f243d	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
7c8eae55-6298-4e1d-a635-e712c230bfbf	Environmental → Air → Indoor	EF 3.1	kg	4
f18cba4d-a0d7-460c-a452-88935f56be91	Environmental → Air → Long-term	EF 3.1	kg	0
aa730084-325e-4710-8f53-b64ef8c5ddfd	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
b23617c4-4b31-4b01-a51e-c45a951c4e5a	Environmental → Air → Unknown	EF 3.1	kg	4
470bf1b4-65d4-4206-802b-f7e86d4659ee	Environmental → Ground → Agricultural	EF 3.1	kg	4
f7f5dee5-3659-4e2d-9c7e-a986e203444e	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
04f05166-43c8-4b57-a5f1-0385b2c8e2e8	Environmental → Ground → Unknown	EF 3.1	kg	4
9db0cc35-a8f4-4199-b44c-cf704c2e4761	Environmental → Water → Long-term	EF 3.1	kg	0
62139acf-f078-4326-a25a-9ed400687740	Environmental → Water → Ocean	EF 3.1	kg	4
eb4c9db5-fde1-4104-ad61-a0f6a8d43328	Environmental → Water → Surface water	EF 3.1	kg	4
fe33664b-01f8-43af-9d16-880223907584	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (54 changes)

Open the changes page

Flow object JSON

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2-chloro-1,1-dimethoxyethane

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Structure

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