ChemicalBook--->CAS DataBase List--->318237-73-9

318237-73-9

318237-73-9 Structure

318237-73-9 Structure
IdentificationBack Directory
[Name]

2-Methyl-1,4,5,6-tetrahydroimidazo[4,5-d][1]benzazepine
[CAS]

318237-73-9
[Synonyms]

Conivaptan-3
Conivaptan int
Conivaptan Impurity 9
Conivaptan impurity C
Conivaptan hydrochkoride Impurity C
Conivaptan Hydrochloride impurity C
2-methyl-3,4,5,6-tetrahydroimidazo[4,5-d][1]benzazepine
2-Methyl-1,4,5,6-tetrahydroimidazo[4,5-d][1]benzazepine
"1,4,5,6-tetrahydro-2-methyl-Imidazo[4,5-d]benzazepine"
1,4,5,6-Tetrahydro-2-methyl-imidazo[4,5-d][1]benzazepine
2-methyl-1,4,5,6-tetrahydrobenzo[b]imidazo[4,5-d]azepine
Imidazo[4,5-d][1]benzazepine, 1,4,5,6-tetrahydro-2-methyl-
[Molecular Formula]

C12H13N3
[MDL Number]

MFCD11046543
[MOL File]

318237-73-9.mol
[Molecular Weight]

199.25
Chemical PropertiesBack Directory
[Melting point ]

178-180 ºC
[Boiling point ]

529.2±19.0 °C(Predicted)
[density ]

1.188
[pka]

14.52±0.20(Predicted)
[InChI]

InChI=1S/C12H13N3/c1-8-14-11-6-7-13-10-5-3-2-4-9(10)12(11)15-8/h2-5,13H,6-7H2,1H3,(H,14,15)
[InChIKey]

QUNIZYMESYDMBI-UHFFFAOYSA-N
[SMILES]

N1C2=CC=CC=C2C2NC(C)=NC=2CC1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Hazard InformationBack Directory
[Uses]

2-Methyl-1,4,5,6-tetrahydrobenzo[b]imidazo[4,5-d]azepine is an impurity of Conivaptan(C384700). Conivaptan is used in the treatment of congestive heart failures.
Spectrum DetailBack Directory
[Spectrum Detail]

2-Methyl-1,4,5,6-tetrahydroimidazo[4,5-d][1]benzazepine(318237-73-9)1HNMR
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