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10-Methylacridinium

HCID 22000
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Basic information

CAS
13367-81-2
Standard SMILES
C[n+]1c2ccccc2cc2ccccc21
InChIKey
GXYLXFITCXXCQV-UHFFFAOYSA-N
Molecular formula
C14H12N+
Average molar mass
194.25 g/mol
Monoisotopic mass
194.09697439

Overview

RN given refers to acridinium parent cpd

Names & identifiers

Preferred name
10-Methylacridinium
IUPAC
10-methylacridin-10-ium
English name
N-methylacridine
Molecular formula
C14H12N+
Molecular weight
194.26

Names & synonyms

10-MethylacridiniumN-Methylacridine13367-81-210-MethylacridineACRIDINIUM, 10-METHYL-5SX6BF4Z5YDTXSID00158297RefChem:163786DTXCID108078810-methylacridin-10-iumBRN 1427204N-methylacridinium
Show more names
UNII-5SX6BF4Z5Y5-20-08-00207 (Beilstein Handbook Reference)SCHEMBL278568CHEMBL3307019SCHEMBL29464772BDBM120263AKOS00506679710-methylacridin-10-ium--iodide (1/1)

Database identifiers

CAS
13367-81-2
PubChem CID
22000
DTXSID
DTXSID00158297
ChEMBL
CHEMBL3307019
UNII
5SX6BF4Z5Y
Nikkaji
J257.618J、J688.474A

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
3.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
15
Formal charge
1
Complexity
203

Physicochemical properties

FDA UNII
5 SX6BF4Z5Y · 5SX6BF4Z5Y

Chemistry & industry

Upstream & downstream products

Upstream raw materials

4,5-Dichloro-3,6-dihydroxy-1,4-cyclohexadiene-1,2-dicarbonitrile4-(2-Bromoacetyl)benzonitrile4-Acetylbenzonitrile2,3-Dichloro-5,6-dicyano-1,4-benzoquinone

Related reactions

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Compound notes

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