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CAS 15031-78-4 2-(4-Pyridyl)-2-propanol molecular structure lightbox
CAS RN: 15031-78-4

2-(4-Pyridyl)-2-propanol

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251217 5g / 25g / 100g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-060274
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g
  • Available purity: >97%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 15031-78-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 2 In Stock Shanghai Inquiry
1g >97% 2 In Stock Shenzhen Inquiry
5g -- 0 Out of Stock Shanghai Inquiry
5g >97% 0 Out of Stock Shanghai Inquiry

15031-78-4 / 2-pyridin-4-ylpropan-2-ol

Standard CAS: 15031-78-4 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
15031-78-4
Multi CAS
No
Molecular Formula
C8H11NO
Molecular Weight
137.180000
Exact Mass
137.084064
SMILES
CC(C)(C1=CC=NC=C1)O
InChI
InChI=1S/C8H11NO/c1-8(2,10)7-3-5-9-6-4-7/h3-6,10H,1-2H3
InChIKey
WEQVCDIJDUVSID-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.38
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
39.48
TPSA
33.12

LogP / Solubility

WLOGP
1.31
MLOGP
1.14
XLogP3
0.6
Consensus LogP
1.02
Log S (ESOL)
-1.89
Class (ESOL)
Soluble
Log S (Ali)
-1.63
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.76
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)
-2.63

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364

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