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(Q72462059)
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English
Diethyl 3-oxoadipate
chemical compound
Diethyl beta-ketoadipate
In more languages
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
216.099773612
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₆O₅
0 references
canonical SMILES
CCOC(=O)CCC(=O)CC(=O)OCC
0 references
Identifiers
InChI
InChI=1S/C10H16O5/c1-3-14-9(12)6-5-8(11)7-10(13)15-4-2/h3-7H2,1-2H3
0 references
InChIKey
ONRIYMIXCUUSNS-UHFFFAOYSA-N
0 references
CAS Registry Number
7149-59-9
1 reference
stated in
CAS Common Chemistry
retrieved
7 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=7149-59-9
InChIKey
ONRIYMIXCUUSNS-UHFFFAOYSA-N
PubChem CID
81576
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
ONRIYMIXCUUSNS-UHFFFAOYSA-N
UniChem compound ID
17279396
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40221712
1 reference
matched by identifier from
InChIKey
InChIKey
ONRIYMIXCUUSNS-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70144203
0 references
NSC number
72263
0 references
EC number
230-479-3
0 references
ECHA Substance Infocard ID
100.027.709
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.027.709
retrieved
29 December 2019
title
Diethyl 3-oxoadipate
(English)
quotation
CAS no.: 7149-59-9
(English)
UNII
UA6Q5C5M4C
1 reference
matched by identifier from
InChIKey
InChIKey
ONRIYMIXCUUSNS-UHFFFAOYSA-N
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