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Menadione nicotinamide bisulfite

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Name

Menadione nicotinamide bisulfite

EINECS 277-543-7
CAS No. 73581-79-0 Density N/A
PSA 142.86000 LogP 2.94600
Solubility N/A Melting Point 182 ºC
Formula C17 H16 N2 O6 S Boiling Point 507.3 ºC at 760 mmHg
Molecular Weight 376.39 . Flash Point 260.6 ºC
Transport Information N/A Appearance pale yellow powder
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 73581-79-0 (1,2,3,4-tetrahydro-2-methyl-1,4-dioxonaphthalene-2-sulphonic acid, compound with nicotin-3-amide (1:1)) Hazard Symbols UN NO.
Synonyms

2-Methoxysulfonyltetralin-1,4-dione; pyridine-3-carboxamide;1,2,3,4-Tetrahydro-2-methyl-1,4-dioxonaphthalene-2-sulphonic acid,compound with nicotin-3-amide (1:1);Vitamin K3 MNB(Menadione nicotinamide bisulfite);2-Methyl-1,4-dioxo-1,2,3,4-tetrahydronaphthalene-2-sulfonic acid·3-pyridinecarboxamide;

 

Menadione nicotinamide bisulfite Chemical Properties


IUPAC Name: Methyl 1,4-dioxo-2,3-dihydronaphthalene-2-sulfonate; pyridine-3-carboxamide
Molecular Formula: C17H16N2O6S
Molecular Weight: 376.38374 g/mol
Canonical SMILES: COS(=O)(=O)C1C(=O)C2=CC=CC=C2C1=O.C1=CC(=CN=C1)C(=O)N
InChI: InChI=1/C11H10O5S.C6H6N2O/c1-16-17(14,15)10-6-9(12)7-4-2-3-5-8(7)11(10)13;7-6(9)5-2-1-3-8-4-5/h2-5,10H,6H2,1H3;1-4H,(H2,7,9)
EINECS: 277-543-7
H-Bond Donor: 1
H-Bond Acceptor: 7
Rotatable Bond Count: 3
Tautomer Count: 8
Exact Mass: 376.072907
MonoIsotopic Mass: 376.072907
Topological Polar Surface Area: 134
Heavy Atom Count: 26
Complexity: 547
Flash Point: 260.6 °C
Enthalpy of Vaporization: 77.74 kJ/mol
Boiling Point: 507.3 °C at 760 mmHg
Melting Point: 182  °C
Vapour Pressure of Menadione nicotinamide bisulfite (CAS NO.73581-79-0): 2.06E-10 mmHg at 25 °C

Menadione nicotinamide bisulfite Specification

  Menadione nicotinamide bisulfite (CAS NO.73581-79-0), its Synonyms are 1,2,3,4-Tetrahydro-2-methyl-1,4-dioxonaphthalene-2-sulphonic acid, compound with nicotin-3-amide (1:1) ; 2-Naphthalenesulfonic acid, 1,2,3,4-tetrahydro-2-methyl-1,4-dioxo-, compd. with 3-pyridinecarboxamide (1:1) ; 2-Naphthalene sulfonic acid, 1,2,3,4-tetrahydro-2-methyl-1,4-dioxo-, compd with 3-pyridinecarboxamide ; 2-Methyl-1,4-dioxo-1,2,3,4-tetrahydronaphthalene-2-sulfonic acid·3-
pyridinecarboxamide . It is pale yellow powder.

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