Basic information
- CAS
94594-90-8- Standard SMILES
CC1(C)C2CCC1C1NS(=O)(=O)CC12- InChIKey
IHFYOCYXHWUKQJ-UHFFFAOYSA-N- Molecular formula
- C10H17NO2S
- Average molar mass
- 215.31 g/mol
- Monoisotopic mass
- 215.09799996
Names & identifiers
- Preferred name
- 10,10-Dimethyl-4lambda6-thia-3-azatricyclo[5.2.1.02,6]decane 4,4-dioxide
- IUPAC
- 10,10-dimethyl-4λ6-thia-3-azatricyclo[5.2.1.02,6]decane 4,4-dioxide
- English name
- (2R)-Bornane-10,2-sultam
- Molecular formula
- C10H17NO2S
- Molecular weight
- 215.31
Names & synonyms
SCHEMBL2831087DTXSID30915411(1S)-(-)-2,10,Camphor sultam10,10-Dimethyl-4lambda6-thia-3-azatricyclo[5.2.1.02,6]decane 4,4-dioxideAKOS024286544ST09493410,10-dimethyl-4-thia-3-azatricyclo[5.2.1.0<2,6>]decane-4,4-dione8,8-Dimethyloctahydro-2H-4,7-methano-2lambda~6~-2,1-benzothiazole-2,2-dione8,8-Dimethyloctahydro-2H-4,7-methano-2lambda~6~-2lambda~6~,1-benzothiazole-2,2-dione(-)-10,2-CAMPHORSULTAMD-SultaM(1S,2R)-(-)-
Show more names
(2R)-Bornane-10(-)-CamphorsultamL-(+)-CAMPHOR SULTAM(2R)-Bornane-10,2-su(1S)-(-)-Camphorsultam(2R)-Borne-10,2-sultam(-)-2,10-Camphorsultam
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 368
Physicochemical properties
- Melting point
- 182 °C · 182 °C
- alpha
- -33 · -33 º (c=4.9, CHCl3)
- Boiling point
- 324.8 · 324.8±25.0 °C(Predicted)
- Density
- 1.1469 · 1.1469 (rough estimate)
- refractive index
- -31 ° · -31 ° (C=1, CHCl3)
- Flash point
- Not applicable
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Chloroform, Ethanol, Methanol
- form
- powder to crystal
- pka
- 11.05 · 11.05±0.40(Predicted)
- color
- White to Almost white
- optical activity
- 19 · [α]19/D 32°, c = 5 in chloroform
- Water Solubility
- Slightly soluble in water.
- BRN
- 83811 · 83811
- InChI
- 1S/C10H17NO2S/c1-9(2)7-3-4-10(9)6-14(12,13)11-8(10)5-7/h7-8,11H,3-6H2,1-2H3/t7-,8-,10-/m1/s1
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
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- hs_code
- 29349990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-37/39-36
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
Uses(1S,2R)-(-)-10,2-Camphorsultam is used in the asymmetric synthesis of (S)- and (R)-N-Fmoc-S-trityl-α-methylcysteine. It is used as proton source in the synthesis of chiral α,γ-substituted γ-butyrolactones. It is also employed as a chiral probe for the optical resolution by HPLC and X-ray crystallographic determination of the absolute stereochemistry of carboxylic acids. Also used to prepare N-acryloyl derivatives which are employed as dienophiles in asymmetric Diels-Alder reactions. and for other asymmetric transformations.
Uses(2R)-Bornane-10,2-sultam is a reagent used to make Camphorsultam conjugates.
Uses(1S)-()-2,10-Camphorsultam may be used in the asymmetric synthesis of (S)- and (R)-N-Fmoc-S-trityl-α-methylcysteine. It may be used as proton source in the synthesis of chiral α,γ-substituted γ-butyrolactones.
General Description(1S,2R,4R)-()-2,10-Camphorsultam may be employed as a chiral probe for the optical resolution by HPLC and X-ray crystallographic determination of the absolute stereochemistry of carboxylic acids.
Upstream & downstream products
Downstream products
Suppliers100 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司
Related reactions
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Compound notes
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