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CAS 27652-89-7 α-(4-Chlorophenyl)-2-pyridinemethanol molecular structure lightbox
CAS RN: 27652-89-7

α-(4-Chlorophenyl)-2-pyridinemethanol

Product Availability

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5 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250427 100g In stock Inquiry
Batchno.20260223 1g In stock Inquiry
Batchno.20250626 25g In stock Inquiry
Batchno.20260418 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250416 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-127734
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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: 100g
  • Available purity: ＞97%
  • 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 27652-89-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ＞97% 0 Out of Stock Shenzhen Inquiry

27652-89-7 / (4-chlorophenyl)-pyridin-2-ylmethanol

Standard CAS: 27652-89-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
27652-89-7
Multi CAS
No
Molecular Formula
C12H10ClNO
Molecular Weight
219.660000
Exact Mass
219.045092
SMILES
C1=CC=NC(=C1)C(C2=CC=C(C=C2)Cl)O
InChI
InChI=1S/C12H10ClNO/c13-10-6-4-9(5-7-10)12(15)11-3-1-2-8-14-11/h1-8,12,15H
InChIKey
ZFUPOFQRQNJDNS-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
2
H-bond donors
1
Molar refractivity
59.75
TPSA
33.12

LogP / Solubility

WLOGP
2.82
MLOGP
2.48
XLogP3
2.1
Consensus LogP
2.47
Log S (ESOL)
-3.44
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.39
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.67
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.06

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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