[email protected]
CAS 6153-06-6 (E)-3-Methylpent-2-en-4-yn-1-ol molecular structure lightbox
CAS RN: 6153-06-6

(E)-3-Methylpent-2-en-4-yn-1-ol

Product Availability

Choose a grade to view its available package options.

3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250817 1g Out of stock Inquiry
Batchno.20250520 250mg In stock Inquiry
Batchno.20251104 50mg In stock Inquiry
  • Product code: SSC-170454
GET A QUOTE
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
Request Bulk Quote

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 6153-06-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

6153-06-6 / 3-methylpent-2-en-4-yn-1-ol

Standard CAS: 6153-06-6 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
6153-06-6
Multi CAS
Yes
Molecular Formula
C6H8O
Molecular Weight
96.130000
Exact Mass
96.057515
InChI
InChI=1S/C6H8O/c1-3-6(2)4-5-7/h1,4,7H,5H2,2H3/b6-4+
InChIKey
ZSJHASYJQIRSLE-GQCTYLIASA-N

Physical Properties

Physical Description
Yellow to orange liquid with a turpene-like odor; [GSBL]
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
29.68
TPSA
20.23

LogP / Solubility

WLOGP
0.56
MLOGP
0.48
XLogP3
0.9
Consensus LogP
0.65
Log S (ESOL)
-0.72
Class (ESOL)
Very soluble
Log S (Ali)
-0.75
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.87
Class (SILICOS-IT)
Very 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)
-2.91

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