[email protected]
CAS 550378-30-8 4-ethynylpiperidine hydrochloride molecular structure lightbox
CAS RN: 550378-30-8

4-ethynylpiperidine hydrochloride

  • Product code: SSC-162884
GET A QUOTE
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: 0.1g, 0.25g, 1g, 5g
  • Available purity: ≥98%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 550378-30-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥98% 1 In Stock Shanghai Inquiry
0.25g ≥98% 1 In Stock Shenzhen Inquiry
1g ≥98% 1 In Stock Beijing Inquiry
5g ≥98% 0 Out of Stock Shanghai Inquiry

550378-30-8 / 4-ethynylpiperidine;hydrochloride

Standard CAS: 550378-30-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
550378-30-8
Multi CAS
No
Molecular Formula
C7H12CLN
Molecular Weight
145.630000
Exact Mass
145.065827
InChI
InChI=1S/C7H11N.ClH/c1-2-7-3-5-8-6-4-7;/h1,7-8H,3-6H2;1H
InChIKey
WZKLBUYGIBQZPJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.71
H-bond acceptors
1
H-bond donors
1
Molar refractivity
41.67
TPSA
12.03

LogP / Solubility

WLOGP
1.04
MLOGP
0.91
XLogP3
1.04
Consensus LogP
1
Log S (ESOL)
-1.4
Class (ESOL)
Soluble
Log S (Ali)
-1.51
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.47
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)
-2.87

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

Customers Also Viewed

Get In Touch

Contact Us