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1,4-Bis(2-(dimethylamino)ethyl) butanedioate

HCID 87986
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
19249-04-8
Standard SMILES
CN(C)CCOC(=O)CCC(=O)OCCN(C)C
InChIKey
JSINVKLVDNFTSU-UHFFFAOYSA-N
Molecular formula
C12H24N2O4
Average molar mass
260.33 g/mol
Monoisotopic mass
260.17360725

Names & identifiers

Preferred name
1,4-Bis(2-(dimethylamino)ethyl) butanedioate
IUPAC
bis[2-(dimethylamino)ethyl] butanedioate
English name
bis[2-(dimethylamino)ethyl] succinate
Molecular formula
C12H24N2O4
Molecular weight
260.33

Names & synonyms

Bis(2-(dimethylamino)ethyl) succinate19249-04-8bis[2-(dimethylamino)ethyl] succinateDTXSID501728421,4-BIS[2-(DIMETHYLAMINO)ETHYL] BUTANEDIOATE1,4-Bis(2-(dimethylamino)ethyl) butanedioateRefChem:1053200DTXCID5095333242-917-0bis[2-(dimethylamino)ethyl] butanedioateBis(2-?(dimethylamino)?ethyl) SuccinateEINECS 242-917-0
Show more names
NISTC19249048Succinylcholine ImpuritySuccinylcholine Impurity 1Choline chloride Impurity 17Butanedioic acid, 1,4-bis[2-(dimethylamino)ethyl] esterPregabalin Sec AmideQ: What is Pregabalin Sec Amide Q: What is the CAS Number of Pregabalin Sec Amide
SCHEMBL30380902-(dimethylamino) ethyl succinateSuxamethonium Chloride Impurity 1bis(2-dimethylaminoethyl) succinateBis-(beta-dimethylaminoethyl)succinateAKOS002860535NS00026278A1-01701

Database identifiers

CAS
19249-04-8

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
59.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
18
Formal charge
0
Complexity
228

Physicochemical properties

Boiling point
130 · 130-135 °C(Press: 1 Torr)
Density
1.0241 g/cm3 · 1.0241 g/cm3
solubility
Chloroform (Sparingly), DMSO (Soluble), Methanol (Slightly)
form
Oil
pka
8.53 · 8.53±0.28(Predicted)
color
Colourless
Stability
Volatile

Chemistry & industry

Applications

UsesBis(2-(dimethylamino)ethyl) Succinate is a potential ligand which may act as an agonist/antagonist to nicotine.

Upstream & downstream products

Upstream raw materials

Diethyl succinateDimethyl succinate

Downstream products

O,O-SUCCINYLDICHOLINE IODIDE

Suppliers14 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
孟成科技(上海)有限公司400-820-6829 · [email protected]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
深圳摩科生化科技有限公司18627923403 · [email protected]
TLC梯尔希(南京)药物研发有限公司18012923235 · [email protected]
南京欣丰康生物科技有限公司025-84683399 13952017251 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]

Related reactions

1 records
New reaction record
HRID 1591380 reaction equation
HRID 1591380As productuspto-grants-1993_04

Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
PubChem CID
87986
DTXSID
DTXSID50172842
EC Number
242-917-0
Nikkaji
J242.753B
河南誉康卓宁进出口有限公司
13393721940 · [email protected]
艾吉析科技(上海)有限公司17717235263 17717235263 · [email protected]
BOC Sciences16314854226 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
常州泽源医药科技有限公司15090501328 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]