CAS RN: 71690-06-7
Pyridine, 2,3-dichloro-5-(difluoromethyl)- (9CI)
Product Availability
Choose a grade to view its available package options.
4 package records3 with current stock1 grade group
- Product code: starshine_CAS71690-06-7
- Purity/Analytical Methods: >99.0%
71690-06-7 / 2,3-dichloro-5-(difluoromethyl)pyridine
Basic Information
CAS
71690-06-7
Multi CAS
No
Molecular Formula
C6H3CL2F2N
Molecular Weight
197.990000
Exact Mass
196.961061
InChI
InChI=1S/C6H3Cl2F2N/c7-4-1-3(6(9)10)2-11-5(4)8/h1-2,6H
InChIKey
ODKRLOKESDPEPD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
39.21
TPSA
12.89
LogP / Solubility
WLOGP
3.33
MLOGP
2.93
XLogP3
3.1
Consensus LogP
3.12
Log S (ESOL)
-3.5
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.58
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.83
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)
-1.57
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
Methyl 3-broMo-4-(diMethylaMino)benzoate
- CAS RN: 71695-21-1
- Product Code: starshine_CAS71695-21-1
- Purity/Analytical method: >99.0%
-
3β-[(6-Deoxy-3-O-methyl-β-D-galactopyranosyl)oxy]-14-oxo-8,15-cyclo-14,15-seco-5β-card-20(22)-enolide
- CAS RN: 71699-08-6
- Product Code: starshine_CAS71699-08-6
- Purity/Analytical method: >99.0%
-
-
5-Chloro-2-fluoro-3-(trifluoromethyl)pyridine
- CAS RN: 71701-96-7
- Product Code: SSC-181289
-
![CAS 71699-08-6 3β-[(6-Deoxy-3-O-methyl-β-D-galactopyranosyl)oxy]-14-oxo-8,15-cyclo-14,15-seco-5β-card-20(22)-enolide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/71699-08-6.gif)
