Chlorobis((1S,2R,3S,5S)-2,6,6-trimethylbicyclo(3.1.1)hept-3-yl)borane
Properties
- Molecular formula
- C20H34BCl
- Molar mass
- 320.75 g/mol
- Exact mass
- 320.2442 Da
- logP
- 6.36Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 2
- Stereocentres
- R, S, S, S, S, R, S, Sin SMILES atom order
Hazards
Danger
- H314 Causes severe skin burns and eye damage100% of notifiers
- H318 Causes serious eye damage28.3% of notifiers
Aggregated from 145 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, P501
Identifiers
CAS number
112246-73-8SMILES
C[C@@H]1[C@@H](B(Cl)[C@H]2C[C@H]3C[C@@H]([C@@H]2C)C3(C)C)C[C@H]2C[C@@H]1C2(C)CInChIKey
PSEHHVRCDVOTID-NAVXHOJHSA-NInChI
InChI=1S/C20H34BCl/c1-11-15-7-13(19(15,3)4)9-17(11)21(22)18-10-14-8-16(12(18)2)20(14,5)6/h11-18H,7-10H2,1-6H3/t11-,12-,13+,14+,15-,16-,17-,18-/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
8 names
- Chlorobis[(1S,2R,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]hept-3-yl]borane
- Borane, chlorobis[(1S,2R,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]hept-3-yl]-
- Borane, chlorobis(2,6,6-trimethylbicyclo[3.1.1]hept-3-yl)-, [1S-[1α,2β,3α(1R*,2S*,3R*,5R*),5α]]-
- (+)-DIP-chloride
- (+)-B-Chlorodiisopinocampheylborane
- (+)-Chlorodiisopinocampheylborane
- (+)-DIP-Cl
- (+)-Diisopinocampheylboron chloride
Work with Chlorobis((1S,2R,3S,5S)-2,6,6-trimethylbicyclo(3.1.1)hept-3-yl)borane
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Pinane473-55-237 % similar
cis-Pinane6876-13-737 % similar
(+)-Pinanediol18680-27-830 % similar
Pinanediol22422-34-030 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.