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ChEBI
> Main
CHEBI:110166 - 2-(2,4-dichlorophenoxy)acetic acid octan-2-yl ester
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ChEBI Ontology
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ChEBI Name
2-(2,4-dichlorophenoxy)acetic acid octan-2-yl ester
ChEBI ID
CHEBI:110166
Stars
This entity has been manually annotated by a third party.
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Formula
C16H22Cl2O3
Net Charge
0
Average Mass
333.251
Monoisotopic Mass
332.09460
InChI
InChI=1S/C16H22Cl2O3/c1-
3-
4-
5-
6-
7-
12(2)
21-
16(19)
11-
20-
15-
9-
8-
13(17)
10-
14(15)
18/h8-
10,12H,3-
7,11H2,1-
2H3
InChIKey
GJNVTNDAZUATRV-UHFFFAOYSA-N
SMILES
CCCCCCC(C)OC(=O)COC1=C(C=C(C=C1)Cl)Cl
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
2-(2,4-dichlorophenoxy)acetic acid octan-2-yl ester (
CHEBI:110166
)
is a
monocarboxylic acid (
CHEBI:25384
)
Manual Xref
Database
LSM-21595
LINCS
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