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2,4-D Diethylamine salt

HCID 62747
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Basic information

CAS
20940-37-8
Standard SMILES
CCNCC.O=C(O)COc1ccc(Cl)cc1Cl
InChIKey
VQRSXYVRBBWVSQ-UHFFFAOYSA-N
Molecular formula
C12H17Cl2NO3
Average molar mass
294.17 g/mol
Monoisotopic mass
293.0585488

Names & identifiers

Preferred name
2,4-D Diethylamine salt
IUPAC
2-(2,4-dichlorophenoxy)acetic acid;N-ethylethanamine

Names & synonyms

2,4-D-diethylammonium2,4-D diethylamine salt20940-37-8U308T4G0CURefChem:1059677244-120-32,4-D-diethylammonium [ISO]Diethylamine 2,4-dichlorophenoxyacetateDiethylamine, (2,4-dichlorophenoxy)acetateDiethylammonium (o,p-dichlorophenoxy)acetateEthanamine, N-ethyl-, (2,4-dichlorophenoxy)acetate2,4-D diethylamine
Show more names
Caswell No. 315MEINECS 244-120-3EPA Pesticide Chemical Code 030017UNII-U308T4G0CU2,4-Dichlorophenoxyacetic acid, diethylamine saltSCHEMBL163983Acetic acid, (2,4-dichlorophenoxy)-, diethylamine saltDTXSID5034305

Database identifiers

CAS
20940-37-8
PubChem CID
62747
DTXSID
DTXSID5034305
UNII
U308T4G0CU
EC Number
244-120-3

Properties

Computed structural properties

Topological polar surface area
58.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
18
Formal charge
0
Complexity
197

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