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CAS 1000549-37-0 2-(3-fluoropyridin-2-yl)ethan-1-ol molecular structure lightbox
CAS RN: 1000549-37-0

2-(3-fluoropyridin-2-yl)ethan-1-ol

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260602 100mg / 500mg Out of stock 5-7 business days Inquiry
  • Product code: SSC-000249
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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: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1000549-37-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1000549-37-0 / 2-(3-fluoro-2-pyridinyl)ethanol

2-(3-FLUOROPYRIDIN-2-YL)ETHAN-1-OL | 1000549-37-0 | 2-Pyridineethanol, 3-fluoro-

Standard CAS: 1000549-37-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1000549-37-0
Multi CAS
No
Molecular Formula
C7H8FNO
Molecular Weight
141.140000
Exact Mass
141.058992
SMILES
C1=CC(=C(N=C1)CCO)F
InChI
InChI=1S/C7H8FNO/c8-6-2-1-4-9-7(6)3-5-10/h1-2,4,10H,3,5H2
InChIKey
WARUSRKZDZSIBO-UHFFFAOYSA-N
Synonyms
2-(3-FLUOROPYRIDIN-2-YL)ETHAN-1-OL 1000549-37-0 2-Pyridineethanol, 3-fluoro- 2-(3-FLUOROPYRIDIN-2-YL)ETHANOL MFCD09926580

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.29
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
34.98
TPSA
33.12

LogP / Solubility

WLOGP
0.76
MLOGP
0.66
XLogP3
0.6
Consensus LogP
0.67
Log S (ESOL)
-1.5
Class (ESOL)
Soluble
Log S (Ali)
-1.26
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.44
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)
-3.04

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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