N-T-Butyl 2-bromobenzamide
Basic information
- CAS
168265-57-4- Standard SMILES
CC(C)(C)NC(=O)c1ccccc1Br- InChIKey
TVNDQPPEFATMSD-UHFFFAOYSA-N- Molecular formula
- C11H14BrNO
- Average molar mass
- 256.14 g/mol
- Monoisotopic mass
- 255.02588
Names & identifiers
- Preferred name
- N-T-Butyl 2-bromobenzamide
- IUPAC
- 2-bromo-N-tert-butylbenzamide
- English name
- 2-bromo-N-(tert-butyl)benzamide
- Molecular formula
- C11H14BrNO
- Molecular weight
- 256.14
Names & synonyms
168265-57-42-Bromo-N-(tert-butyl)benzamideN-T-BUTYL 2-BROMOBENZAMIDE2-bromo-N-tert-butylbenzamideMFCD00462994N-tert-butyl 2-bromobenzamideBenzamide, 2-bromo-N-(1,1-dimethylethyl)-SCHEMBL91297872-bromo-N-tert-butyl-benzamideDTXSID90352262TVNDQPPEFATMSD-UHFFFAOYSA-NSTK012694
Show more names
2-Bromo-N-(1,1-dimethylethyl)benzamide
AKOS000197863BS-21704N-(tert-butyl)(2-bromophenyl)carboxamideST013970DB-371630CS-0196847E73956Z28277793
Database identifiers
- CAS
168265-57-4- PubChem CID
- 721901
- DTXSID
DTXSID90352262
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 210
Physicochemical properties
- Boiling point
- 342.2 · 342.2±25.0 °C(Predicted)
- Density
- 1.309 · 1.309±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 14.23 · 14.23±0.46(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P403+P233-P405-P501
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
- H315-H319-H335
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P403+P233-P405-P501
Related reactions
1 records
Compound notes
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