CAS RN: 1453854-84-6
1,2-Ethanediol, 1-(4-chloro-3-fluorophenyl)-, (1R)-
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260310 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-056722
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 0.25g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 0.25g | ≥95% | 0 Out of Stock | Shanghai | Inquiry |
1453854-84-6 / (1R)-1-(4-chloro-3-fluorophenyl)ethane-1,2-diol
Basic Information
CAS
1453854-84-6
Multi CAS
No
Molecular Formula
C8H8ClFO2
Molecular Weight
190.600000
Exact Mass
190.019685
SMILES
C1=CC(=C(C=C1[C@H](CO)O)F)Cl
InChI
InChI=1S/C8H8ClFO2/c9-6-2-1-5(3-7(6)10)8(12)4-11/h1-3,8,11-12H,4H2/t8-/m0/s1
InChIKey
ZNGGAPYUQROFJC-QMMMGPOBSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
43.46
TPSA
40.46
LogP / Solubility
WLOGP
1.5
MLOGP
1.32
XLogP3
0.4
Consensus LogP
1.07
Log S (ESOL)
-2.21
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.21
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.39
Class (SILICOS-IT)
Moderately 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)
-2.81
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
![CAS 1454257-32-9 “3-[[3,5-Bis(trifluoromethyl)phenyl]amino]-4-[[(1R,2R)-1,2-diphenyl-2-(1-piperidinyl)ethyl]amino]-3-cyclobutene-1,2-dione” molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1454257-32-9.gif)
“3-[[3,5-Bis(trifluoromethyl)phenyl]amino]-4-[[(1R,2R)-1,2-diphenyl-2-(1-piperidinyl)ethyl]amino]-3-cyclobutene-1,2-dione”
- CAS RN: 1454257-32-9
- Product Code: starshine_CAS1454257-32-9
- Purity/Analytical method: >99.0%
-
![CAS 1454273-40-5 Ethyl 8-Benzyl-3-Oxo-1-Oxa-8-Azaspiro[4.5]decane-4-Carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1454273-40-5.gif)
Ethyl 8-Benzyl-3-Oxo-1-Oxa-8-Azaspiro[4.5]decane-4-Carboxylate
- CAS RN: 1454273-40-5
- Product Code: SSC-056742
-
Rovazolac
- CAS RN: 1454288-88-0
- Product Code: starshine_CAS1454288-88-0
- Purity/Analytical method: >99.0%
-
![CAS 1454301-73-5 [6-(trifluoromethyl)-1H-indazol-4-yl]boronic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1454301-73-5.gif)
[6-(trifluoromethyl)-1H-indazol-4-yl]boronic acid
- CAS RN: 1454301-73-5
- Product Code: SSC-056750
-
![CAS 1454319-47-1 (S)-[2’-Benzyl-[1,1’-binaphthalen]-2-yl]diphenylphosphine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1454319-47-1.gif)
(S)-[2’-Benzyl-[1,1’-binaphthalen]-2-yl]diphenylphosphine
- CAS RN: 1454319-47-1
- Product Code: SSC-056751
-
![CAS 1454319-48-2 (S)-[2’-(2-Methoxybenzyl)-[1,1’-binaphthalen]-2-yl]diphenylphosphine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1454319-48-2.gif)
(S)-[2’-(2-Methoxybenzyl)-[1,1’-binaphthalen]-2-yl]diphenylphosphine
- CAS RN: 1454319-48-2
- Product Code: SSC-056752