CAS RN: 58970-19-7
4-CHLORO-4′-METHOXYBIPHENYL
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250121 | 100mg / 250mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS58970-19-7
- Purity/Analytical Methods: >99.0%
58970-19-7 / 1-chloro-4-(4-methoxyphenyl)benzene
Basic Information
CAS
58970-19-7
Multi CAS
Yes
Molecular Formula
C13H11CLO
Molecular Weight
218.680000
Exact Mass
218.049843
InChI
InChI=1S/C13H11ClO/c1-15-13-8-4-11(5-9-13)10-2-6-12(14)7-3-10/h2-9H,1H3
InChIKey
PUVSUQVVUYQOBK-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
12
Fraction Csp3
0.08
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
63.44
TPSA
9.23
LogP / Solubility
WLOGP
4.02
MLOGP
3.54
XLogP3
4.9
Consensus LogP
4.15
Log S (ESOL)
-4.19
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.25
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.65
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.2
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
-
(2,4-DIMETHYL-PHENYL)-PHOSPHONIC ACID DIETHYL ESTER
- CAS RN: 58983-20-3
- Product Code: SSC-167334
-
-
L-Alanine,propylester(9CI)
- CAS RN: 58989-06-3
- Product Code: starshine_CAS58989-06-3
- Purity/Analytical method: >99.0%
-
4-Methylumbelliferyl b-D-glucosaminide
- CAS RN: 58989-36-9
- Product Code: starshine_CAS58989-36-9
- Purity/Analytical method: >99.0%
