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Dimethyl adipimidate dihydrochloride

HCID 12876176
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Basic information

CAS
14620-72-5
Standard SMILES
COC(=N)CCCCC(=N)OC.Cl.Cl
InChIKey
IEUUDEWWMRQUDS-UHFFFAOYSA-N
Molecular formula
C8H18Cl2N2O2
Average molar mass
245.14 g/mol
Monoisotopic mass
244.0745332

Names & identifiers

Preferred name
Dimethyl adipimidate dihydrochloride
IUPAC
dimethyl hexanediimidate;dihydrochloride
English name
Dimethyl adipimidate dihydrochloride
Molecular formula
C8H17ClN2O2
Molecular weight
208.69

Names & synonyms

Dimethyl adipimidate dihydrochloride14620-72-5Dimethyl adipimidate HClUNII-WHO0F998GMWHO0F998GMEINECS 238-660-9DIMETHYL ADIPIMIDATE 2HCLNSC 340006NSC-340006ADIPIMIDIC ACID, DIMETHYL ESTER, DIHYDROCHLORIDEHEXANEDIIMIDIC ACID, DIMETHYL ESTER, DIHYDROCHLORIDERefChem:134219
Show more names
dimethyl hexanediimidateDIMETHYL ADIPIMIDATE 2 HCLDiMethyl adipiMidate2HCl(DMA)Adipimidicaciddimethylester2HClDiMethyl adipiMidate dihydrochloride 97%DIMETHYL ADIPIMIDATE DIHYDROCHLORIDE, 99 %
238-660-9dimethyl hexanediimidate;dihydrochlorideDimethyl adipimidate diHClAdipimidic Acid Dimethyl Ester DihydrochlorideMFCD00012573Hexanediimidic acid, 1,6-dimethyl ester, hydrochloride (1:2)1,6-DIMETHYL HEXANEDIIMIDATE DIHYDROCHLORIDEadipimidic acid dimethyl ester

Database identifiers

CAS
14620-72-5
PubChem CID
12876176
DTXSID
DTXSID101374299
UNII
WHO0F998GM
EC Number
238-660-9

Properties

Computed structural properties

Topological polar surface area
66.2 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
14
Formal charge
0
Complexity
139

Experimental & physicochemical properties

Chemical ClassesOther Uses -> Biochemical Research
Physical DescriptionWhite solid; [Alfa Aesar MSDS]

Physicochemical properties

Melting point
215 · 215-220 °C (dec.)(lit.)
storage temp.
2 · 2-8°C
form
powder to crystal
color
White to Almost white
Water Solubility
Hydrolyses in water.
Sensitive
Moisture Sensitive
CAS DataBase Reference
14620 · 14620-72-5(CAS DataBase Reference)
FDA UNII
0 F998GM · WHO0F998GM
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07
Signal word
Warning

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazards SummaryHydrolyzed by water; A skin and strong eye irritant; [Alfa Aesar MSDS]
Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

F
3-10-21
wgk
3
hs_code
2925290090
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36
Hazard statements
H315-H319-H335
Precautionary statements
P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Uses & manufacturing

UsesUsed as a reagent or fixative in immunohistochemistry; [ChemIDplus]

Applications

UsesDimethyl adipimidate dihydrochloride was used as a cross-linking reagent in the study of rhodopsin in sheep photoreceptor membrane

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
WGK Germany
3 · 3
F
3 · 3-10-21
HS Code
2925290090 · 2925290090