AC1MHQF7 structure

AC1MHQF7

bis(2-(2-butanoyloxypropanoyloxy)ethyl-trimethylazanium);naphthalene-2,6-disulfonate

Also Known As: Ethanaminium, 2-(2-(1-oxobutoxy)-1-oxopropoxy)-N,N,N-trimethyl-, 2,6- naphthalenedisulfonate (2:1)|Ethanaminium, 2-(2-(1-oxobutoxy)-1-oxopropoxy)-N,N,N-trimethyl-, 2,6-naphthalenedisulfonate (2:1)|2-(2-butanoyloxypropanoyloxy)ethyl-trimethyl-azanium; naphthalene-2,6-disulfonate|2-(2-butanoyloxypropanoyloxy)ethyl-trimethylazanium,naphthalene-2,6-disulfonate|2-(2-butanoyloxypropanoyloxy)ethyl-trimethylazanium; naphthalene-2,6-disulfonate|Bis(2-{[2-(butanoyloxy)propanoyl]oxy}-N,N,N-trimethylethan-1-aminium) naphthalene-2,6-disulfonate

CAS: 73231-79-5
Molecular Formula C34H54N2O14S2
Molecular Weight 778.30164 g/mol
LogP 2.5832
Topological Polar Surface Area 219.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 14
Rotatable Bonds 16
Exact Mass 778.30164
Monoisotopic Mass 778.30164
Heavy Atoms 52
Complexity 1571.3124

Chemical Identifiers

CAS Number 73231-79-5
SMILES CCCC(=O)OC(C)C(=O)OCC[N+](C)(C)C.CCCC(=O)OC(C)C(=O)OCC[N+](C)(C)C.C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C=C1S(=O)(=O)[O-]

Product Overview

AC1MHQF7 (CAS 73231-79-5), with molecular formula C34H54N2O14S2 and molecular weight 778.30164 g/mol. IUPAC: bis(2-(2-butanoyloxypropanoyloxy)ethyl-trimethylazanium);naphthalene-2,6-disulfonate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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