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Structure

Ammonium isopropylammonium 1-[1-methyl-2-(oleoylamino)ethyl]sulfonatosuccinate

CAS
94159-68-9
Catalog Number
ACM94159689
Category
Other Products
Molecular Weight
595.832480 [g/mol]
Molecular Formula
C28H57N3O8S

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Specification

Synonyms
CTK3I7524, Ammonium isopropylammonium 1-(1-methyl-2-(oleoylamino)ethyl) sulphonatosuccinate, 94159-68-9, AG-H-87809
IUPAC Name
azanium;4-[1-(octadec-9-enoylamino)propan-2-yloxy]-4-oxo-3-sulfonatobutanoate;propan-2-ylazanium
InChI Key
JPZAHCNEFAGBBS-UHFFFAOYSA-N
H-Bond Acceptor
8
H-Bond Donor
3
What is the molecular formula of Ammonium isopropylammonium 1-[1-methyl-2-(oleoylamino)ethyl]sulfonatosuccinate?

The molecular formula is C28H57N3O8S.

What is the molecular weight of Ammonium isopropylammonium 1-[1-methyl-2-(oleoylamino)ethyl]sulfonatosuccinate?

The molecular weight is 595.8 g/mol.

When was Ammonium isopropylammonium 1-[1-methyl-2-(oleoylamino)ethyl]sulfonatosuccinate created?

It was created on 2008-12-10.

What is the IUPAC name of Ammonium isopropylammonium 1-[1-methyl-2-(oleoylamino)ethyl]sulfonatosuccinate?

The IUPAC name is azanium;4-[1-[[(Z)-octadec-9-enoyl]amino]propan-2-yloxy]-4-oxo-3-sulfonatobutanoate;propan-2-ylazanium.

What is the Canonical SMILES of Ammonium isopropylammonium 1-[1-methyl-2-(oleoylamino)ethyl]sulfonatosuccinate?

The Canonical SMILES is CCCCCCCCC=CCCCCCCCC(=O)NCC(C)OC(=O)C(CC(=O)[O-])S(=O)(=O)[O-].CC(C)[NH3+].[NH4+].

What is the InChIKey of Ammonium isopropylammonium 1-[1-methyl-2-(oleoylamino)ethyl]sulfonatosuccinate?

The InChIKey is JPZAHCNEFAGBBS-PQBRBDCOSA-N.

What is the CAS number of Ammonium isopropylammonium 1-[1-methyl-2-(oleoylamino)ethyl]sulfonatosuccinate?

The CAS number is 94159-68-9.

How many hydrogen bond donor counts are there in Ammonium isopropylammonium 1-[1-methyl-2-(oleoylamino)ethyl]sulfonatosuccinate?

There are 3 hydrogen bond donor counts.

What is the exact mass of Ammonium isopropylammonium 1-[1-methyl-2-(oleoylamino)ethyl]sulfonatosuccinate?

The exact mass is 595.38663696 g/mol.

How many rotatable bond counts are there in Ammonium isopropylammonium 1-[1-methyl-2-(oleoylamino)ethyl]sulfonatosuccinate?

There are 21 rotatable bond counts.

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