ChemicalBook--->CAS DataBase List--->404857-69-8

404857-69-8

404857-69-8 Structure

404857-69-8 Structure
IdentificationBack Directory
[Name]

2-(2-Bromoisobutyryloxy)undecyl thiol
[CAS]

404857-69-8
[Synonyms]

2-(2-Bromoisobutyryloxy)undecyl thiol
ω-Mercaptoundecyl bromoisobutyrate (MUBiB)
11-mercaptoundecyl 2-bromo-2-methylpropanoate
Propanoic acid, 2-bromo-2-methyl-, 11-mercaptoundecyl ester
[Molecular Formula]

C15H29BrO2S
[MDL Number]

MFCD32706494
[MOL File]

404857-69-8.mol
[Molecular Weight]

353.36
Chemical PropertiesBack Directory
[Boiling point ]

391.0±12.0 °C(Predicted)
[density ]

1.151±0.06 g/cm3(Predicted)
[pka]

10.49±0.10(Predicted)
[InChI]

InChI=1S/C15H29BrO2S/c1-15(2,16)14(17)18-12-10-8-6-4-3-5-7-9-11-13-19/h19H,3-13H2,1-2H3
[InChIKey]

JVQTWZGZUCJHRV-UHFFFAOYSA-N
[SMILES]

C(OCCCCCCCCCCCS)(=O)C(Br)(C)C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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