CAS RN: 2155-42-2
3,5-Dichlorostyrene
Product Availability
Choose a grade to view its available package options.
4 package records2 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250116 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS2155-42-2
- Purity/Analytical Methods: >99.0%
2155-42-2 / 1,3-dichloro-5-ethenylbenzene
Basic Information
CAS
2155-42-2
Multi CAS
No
Molecular Formula
C8H6Cl2
Molecular Weight
173.040000
Exact Mass
171.984656
SMILES
C=CC1=CC(=CC(=C1)Cl)Cl
InChI
InChI=1S/C8H6Cl2/c1-2-6-3-7(9)5-8(10)4-6/h2-5H,1H2
InChIKey
RVZNTKZAFRNXIK-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
Rotatable bonds
1
Molar refractivity
46.55
TPSA
0.0000
LogP / Solubility
WLOGP
3.64
MLOGP
3.2
XLogP3
4
Consensus LogP
3.61
Log S (ESOL)
-3.58
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.6
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.92
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)
-1.19
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
SU5402
- CAS RN: 215543-92-3
- Product Code: starshine_CAS215543-92-3
- Purity/Analytical method: >99.0%
-
-
-
4-(1-PYRROLIDINO)ACETOPHENONE
- CAS RN: 21557-09-5
- Product Code: starshine_CAS21557-09-5
- Purity/Analytical method: >99.0%
-
1-(4-PHENYLPIPERAZIN-1-YL)ETHANONE
- CAS RN: 21557-13-1
- Product Code: starshine_CAS21557-13-1
- Purity/Analytical method: >99.0%
-
1,2:3,4-DIBENZANTHRACENE
- CAS RN: 215-58-7
- Product Code: starshine_CAS215-58-7
- Purity/Analytical method: >99.0%
