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Structure

(Butyl)[2-(diethylammonio)ethyl](1-naphthoyl)ammonium hydrogen citrate

CAS
94157-87-6
Catalog Number
ACM94157876
Category
Other Products
Molecular Weight
518.59922
Molecular Formula
C21H30N2O.C6H8O7

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Specification

Synonyms
EINECS 303-055-1, (Butyl)(2-(diethylammonio)ethyl)(1-naphthoyl)ammonium hydrogen citrate, 94157-87-6
IUPAC Name
butyl-[2-(diethylazaniumyl)ethyl]-(naphthalene-1-carbonyl)azanium; 2-(carboxymethyl)-2-hydroxybutanedioate
Canonical SMILES
CCCC[NH+](CC[NH+](CC)CC)C(=O)C1=CC=CC2=CC=CC=C21.C(C(=O)O)C(CC(=O)[O-])(C(=O)[O-])O
InChI Key
ROPZWLPGYFZSSN-UHFFFAOYSA-N
Boiling Point
664.7ºC at 760 mmHg
Flash Point
355.8ºC
Density
g/cm³
EC Number
303-055-1
Exact Mass
518.26300
H-Bond Acceptor
8
H-Bond Donor
4
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