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163798-87-6

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163798-87-6 Structure

163798-87-6 Structure
IdentificationBack Directory
[Name]

tert-butyl 2-(chloromethyl)-1H-benzimidazole-1-carboxylate
[CAS]

163798-87-6
[Synonyms]

1-(tert-Butoxycarbonyl)-2-(chloromethyl)-benzimidazole
tert-butyl 2-(chloromethyl)-1H-benzimidazole-1-carboxylate
tert-butyl 2-(chloromethyl)-1H-1,3-benzodiazole-1-carboxylate
tert-butyl 2-(chloroMethyl)-1H-benzo[d]iMidazole-1-carboxylate
1H-BenziMidazole-1-carboxylic acid, 2-(chloroMethyl)-, 1,1-diMethylethyl ester
[Molecular Formula]

C13H15ClN2O2
[MDL Number]

MFCD10697638
[MOL File]

163798-87-6.mol
[Molecular Weight]

266.72
Chemical PropertiesBack Directory
[Boiling point ]

377.6±44.0 °C(Predicted)
[density ]

1.23±0.1 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[pka]

2.01±0.10(Predicted)
[InChI]

InChI=1S/C13H15ClN2O2/c1-13(2,3)18-12(17)16-10-7-5-4-6-9(10)15-11(16)8-14/h4-7H,8H2,1-3H3
[InChIKey]

YNZUHDHIWWRGOR-UHFFFAOYSA-N
[SMILES]

C1(CCl)N(C(OC(C)(C)C)=O)C2=CC=CC=C2N=1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HazardClass ]

IRRITANT
Hazard InformationBack Directory
[Uses]

tert-butyl 2-(chloromethyl)-1H-benzimidazole-1-carboxylate is used in organic synthesis.
Spectrum DetailBack Directory
[Spectrum Detail]

tert-butyl 2-(chloromethyl)-1H-benzimidazole-1-carboxylate(163798-87-6)1HNMR
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