Basic information
- CAS
1116-39-8- Standard SMILES
CC(C)CB(CC(C)C)CC(C)C- InChIKey
XDSSGQHOYWGIKC-UHFFFAOYSA-N- Molecular formula
- C12H27B
- Average molar mass
- 182.16 g/mol
- Monoisotopic mass
- 182.22058126
Names & identifiers
- Preferred name
- Triisobutylborane
- IUPAC
- tris(2-methylpropyl)borane
- English name
- triisobutylborane
- Molecular formula
- C12H27B
- Molecular weight
- 182.15378
Names & synonyms
Triisobutylborane1116-39-8Borane, tris(2-methylpropyl)-EINECS 214-235-3DTXSID3061500XDSSGQHOYWGIKC-UHFFFAOYSA-RefChem:899663DTXCID7033234214-235-3InChI=1/C12H27B/c1-10(2)7-13(8-11(3)4)9-12(5)6/h10-12H,7-9H2,1-6H3tris(2-methylpropyl)boraneSCHEMBL77787
Show more names
TriisobutylboronTriisobutylboran
DB-257197NS00044423
Database identifiers
- CAS
1116-39-8- PubChem CID
- 70691
- DTXSID
DTXSID3061500- EC Number
- 214-235-3
- Nikkaji
- J203.336D
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 92.5
Physicochemical properties
- Boiling point
- 188 °C · 188°C
- Density
- 0.738 · 0.7380
- refractive index
- 1.4188 · 1.4188
- EPA Substance Registry System
- Triisobutylborane (1116-39-8)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBorane, tris(2-methylpropyl)-: INACTIVE
Suppliers2 total
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
Related reactions
2 records
Compound notes
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