CAS RN: 884494-86-4
2-CHLORO-5-FLUORO-4-(HYDROXYMETHYL)PYRIDINE
- Product code: SSC-199098
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: 5g
- Available purity: ＞97%
- 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 |
|---|---|---|---|---|
| 5g | ＞97% | 0 Out of Stock | Shanghai | Inquiry |
884494-86-4 / (2-chloro-5-fluoro-4-pyridinyl)methanol
Basic Information
CAS
884494-86-4
Multi CAS
No
Molecular Formula
C6H5CLFNO
Molecular Weight
161.560000
Exact Mass
161.004370
InChI
InChI=1S/C6H5ClFNO/c7-6-1-4(3-10)5(8)2-9-6/h1-2,10H,3H2
InChIKey
ULYHGGNKEUYIKI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
35.13
TPSA
33.12
LogP / Solubility
WLOGP
1.37
MLOGP
1.2
XLogP3
1
Consensus LogP
1.19
Log S (ESOL)
-2.08
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.87
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.96
Class (SILICOS-IT)
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)
-2.74
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
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5-METHYLNICOTINOYL CHLORIDE
- CAS RN: 884494-95-5
- Product Code: starshine_CAS884494-95-5
- Purity/Analytical method: >99.0%
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