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CAS 100189-17-1 6-Methyl-3-pyridineethanol molecular structure lightbox
CAS RN: 100189-17-1

6-Methyl-3-pyridineethanol

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260524 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-000594
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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 100189-17-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

100189-17-1 / 2-(6-methyl-3-pyridinyl)ethanol

6-methyl-3-Pyridineethanol | 2-(6-methylpyridin-3-yl)ethanol | 3-Pyridineethanol, 6-methyl-

Standard CAS: 100189-17-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
100189-17-1
Multi CAS
No
Molecular Formula
C8H11NO
Molecular Weight
137.180000
Exact Mass
137.084064
SMILES
CC1=NC=C(C=C1)CCO
InChI
InChI=1S/C8H11NO/c1-7-2-3-8(4-5-10)6-9-7/h2-3,6,10H,4-5H2,1H3
InChIKey
CRZJKFRQNPDUIV-UHFFFAOYSA-N
Synonyms
6-methyl-3-Pyridineethanol 2-(6-methylpyridin-3-yl)ethanol 3-Pyridineethanol, 6-methyl- 2-(6-methylpyridin-3-yl)ethan-1-ol MFCD09926432

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.38
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
39.76
TPSA
33.12

LogP / Solubility

WLOGP
0.92
MLOGP
0.81
XLogP3
0.8
Consensus LogP
0.84
Log S (ESOL)
-1.59
Class (ESOL)
Soluble
Log S (Ali)
-1.35
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.56
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)
-2.9

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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