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1h-imidazolium, 1-(2-(carboxymethoxy)ethyl)-1-(carboxymethyl)-2-heptyl-4,5-dihydro-, hydroxide, disodium salt

HCID 82172
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
7702-01-4
Standard SMILES
CCCCCCCC1=NCC[N+]1(CCOCC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[OH-]
InChIKey
IJOBQWAGGNHDEV-UHFFFAOYSA-L
Molecular formula
C16H28N2Na2O6
Average molar mass
390.38 g/mol
Monoisotopic mass
390.17427518

Names & identifiers

Preferred name
1h-imidazolium, 1-(2-(carboxymethoxy)ethyl)-1-(carboxymethyl)-2-heptyl-4,5-dihydro-, hydroxide, disodium salt
IUPAC
disodium;2-[1-[2-(carboxylatomethoxy)ethyl]-2-heptyl-4,5-dihydroimidazol-1-ium-1-yl]acetate;hydroxide
English name
disodium 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-2-heptyl-4,5-dihydro-1H-imidazolium hydroxide
Molecular formula
C16H31N2NaO6
Molecular weight
370.42

Names & synonyms

1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-2-heptyl-4,5-dihydro-, hydroxide, sodium salt (1:1:2)1H-Imidazolium, 1-(2-(carboxymethoxy)ethyl)-1-(carboxymethyl)-2-heptyl-4,5-dihydro-, hydroxide, disodium salt1H-Imidazolium, 1-(2-(carboxymethoxy)ethyl)-1-(carboxymethyl)-2-heptyl-4,5-dihydro-, hydroxide, sodium salt (1:1:2)1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-2-heptyl-4,5-dihydro-, hydroxide, disodium saltRefChem:4384597702-01-4CapryloamphocarboxyglycinateSCHEMBL5606489IJOBQWAGGNHDEV-UHFFFAOYSA-LDTXSID601014684EINECS 231-721-01H-Imidazolium, 1-(2-(carboxymethoxy)ethyl)-1-(carboxymethyl)-2-heptyl-4,5-dihydr- o-, hydroxide, disodium salt
Show more names
Miranol J 2MMackam 2CY75disodium 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-2-heptyl-4,5-dihydro-1H-imidazolium hydroxide1-[2-(Carboxymethoxy)ethyl]-1-(carboxymethyl)-2-heptyl-4,5-dihydro-1H-imidazolium hydroxide disodium salt

Properties

Computed structural properties

Topological polar surface area
103 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
11
Heavy atoms
26
Formal charge
0
Complexity
414

Physicochemical properties

EPA Substance Registry System
1 H-Imidazolium, · 1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-2-heptyl-4,5-dihydro-, hydroxide, disodium salt (7702-01-4)
TSCA
TSCA listed

Safety & regulation

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

Hazard information

Regulatory InformationChemical: 1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-2-heptyl-4,5-dihydro-, hydroxide, disodium salt

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-2-heptyl-4,5-dihydro-, hydroxide, sodium salt (1:1:2): ACTIVE

Suppliers1 total

湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
2-Heptyl-1-(sodium carboxymethyl)-1-(2-(sodium carboxymethoxy)ethyl)-2-imidazolinium hydroxideDisodium 1-(2-(carboxymethoxy)ethyl)-1-(carboxymethyl)-2-heptyl-4,5-dihydro-1H-imidazolium hydroxideSodium hydroxide {1-[2-(carboxylatomethoxy)ethyl]-2-heptyl-4,5-dihydro-1H-imidazol-1-ium-1-yl}acetate (2/1/1)

Database identifiers

CAS
7702-01-4
PubChem CID
82172
DTXSID
DTXSID601014684
EC Number
231-721-0