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3-Methyl-2-dimethylamino-imidazo[4,5-f]quinoline

HCID 93535
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Basic information

CAS
102408-27-5
Standard SMILES
CN(C)c1nc2c3cccnc3ccc2n1C
InChIKey
UWIKYLLSLVQQIG-UHFFFAOYSA-N
Molecular formula
C13H14N4
Average molar mass
226.28 g/mol
Monoisotopic mass
226.12184646

Names & identifiers

Preferred name
3-Methyl-2-dimethylamino-imidazo[4,5-f]quinoline
IUPAC
N,N,3-trimethylimidazo[4,5-f]quinolin-2-amine
English name
3-Methyl-2-dimethylamino-imidazo[4,5-F]quinoline
Molecular formula
C13H14N4
Molecular weight
226.28

Names & synonyms

102408-27-53-Methyl-2-dimethylamino-imidazo[4,5-f]quinolineN,N,3-trimethylimidazo[4,5-f]quinolin-2-amine3-Methyl-2,2-dimethylaminoimidazo(4,5-f)quinoline3H-Imidazo[4,5-f]quinolin-2-amine, N,N,3-trimethyl-CT2M57B64QN,N,3-trimethyl-3H-imidazo[4,5-f]quinolin-2-amine3H-Imidazo[4,5-f]quinolin-2-amine,N,N,3-trimethyl-3-Methyl-2-dimethylamino-imidazo(4,5-f)quinolineN,N,3-Trimethyl-3H-imidazo(4,5-f)quinolin-2-amineN-Dimethyl-IQCCRIS 4368
Show more names
3H-Imidazo(4,5-f)quinolin-2-amine, N,N,3-trimethyl-3-METHYL-2,2-DIMETHYLAMINOIMIDAZO[4,5-F]QUINOLINE3H-IMIDAZO(4,5-F)QUINOLIN-2-AMINE,N,N,3-TRIMETHYL-DIMETHYL-IQ, N-UNII-CT2M57B64QNIOSH/NJ5906400DTXSID00145046AKOS030254632

Database identifiers

CAS
102408-27-5
PubChem CID
93535
DTXSID
DTXSID00145046
UNII
CT2M57B64Q
Nikkaji
J484.713J

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
34 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
17
Formal charge
0
Complexity
281

Experimental & physicochemical properties

LogP2.28

Physicochemical properties

Melting point
64 · 64-66°C
FDA UNII
2 M57B64Q · CT2M57B64Q
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Applications

UsesExhibits an extraordinarily high mutagenic potency in the Ames test.

Related reactions

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Compound notes

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