CAS RN: 21286-54-4
(+)-10-Camphorsulfonyl Chloride
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250610 | 1g / 5g / 25g / 100g | Confirm by inquiry | Shanghai, Hebei, Shandong | Inquiry |
- Product code: ICTC0998
- Purity/Analytical Methods: >97.0%(GC)(T)
21286-54-4 / [(1S,4R)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonyl chloride
Basic Information
CAS
21286-54-4
Multi CAS
No
Molecular Formula
C10H15ClO3S
Molecular Weight
250.740000
Exact Mass
250.043043
SMILES
CC1([C@@H]2CC[C@]1(C(=O)C2)CS(=O)(=O)Cl)C
InChI
InChI=1S/C10H15ClO3S/c1-9(2)7-3-4-10(9,8(12)5-7)6-15(11,13)14/h7H,3-6H2,1-2H3/t7-,10-/m1/s1
InChIKey
BGABKEVTHIJBIW-GMSGAONNSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Fraction Csp3
0.9
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
58.2
TPSA
51.21
LogP / Solubility
WLOGP
1.95
MLOGP
1.72
XLogP3
1.8
Consensus LogP
1.82
Log S (ESOL)
-2.49
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.02
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.15
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.86
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
4.5
