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171429-39-3

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171429-39-3 Structure

171429-39-3 Structure
IdentificationBack Directory
[Name]

3-(5-carboxypentyl)-1,1,2-trimethyl-1H-benzo[e]indol-3-ium bromide
[CAS]

171429-39-3
[Synonyms]

3-(5-carboxypentyl)-1,1,2-trimethyl-1H-benzo[e]indol-3-ium bromide
[Molecular Formula]

C21H26BrNO2
[MDL Number]

MFCD22573579
[MOL File]

171429-39-3.mol
[Molecular Weight]

404.35
Chemical PropertiesBack Directory
[storage temp. ]

2-8°C, sealed storage, away from moisture
[Appearance]

Off-white to light yellow Solid
[InChI]

InChI=1S/C21H25NO2.BrH/c1-15-21(2,3)20-17-10-7-6-9-16(17)12-13-18(20)22(15)14-8-4-5-11-19(23)24;/h6-7,9-10,12-13H,4-5,8,11,14H2,1-3H3;1H
[InChIKey]

XSXHHAQBMIWSEH-UHFFFAOYSA-N
[SMILES]

CC1(C(=[N+](CCCCCC(=O)O)C2=CC=C3C=CC=CC3=C12)C)C.[Br-]
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P280-P305+P351+P338
Spectrum DetailBack Directory
[Spectrum Detail]

3-(5-carboxypentyl)-1,1,2-trimethyl-1H-benzo[e]indol-3-ium bromide(171429-39-3)1HNMR
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