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CAS 2935-44-6 2,5-Hexanediol molecular structure lightbox
CAS RN: 2935-44-6

2,5-Hexanediol

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260612 1ml / 5ml / 25ml / 100ml Confirm by inquiry Shanghai, Shandong, Guangdong, Hebei 8-10 business days Inquiry
  • Product code: SSC-132024
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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: 25g
  • Available purity: ≥98%
  • 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 2935-44-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥98% 0 Out of Stock Beijing Inquiry

2935-44-6 / hexane-2,5-diol

Standard CAS: 2935-44-6 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
2935-44-6
Multi CAS
No
Molecular Formula
C6H14O2
Molecular Weight
118.170000
Exact Mass
118.099380
InChI
InChI=1S/C6H14O2/c1-5(7)3-4-6(2)8/h5-8H,3-4H2,1-2H3
InChIKey
OHMBHFSEKCCCBW-UHFFFAOYSA-N

Physical Properties

Melting Point
43 °C
Boiling Point
216 °C
Density
Relative density (water = 1): 0.97
Physical Description
Liquid Colorless liquid; [ICSC] Light yellow viscous liquid; COLOURLESS LIQUID.
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
2
Molar refractivity
32.6
TPSA
40.46

LogP / Solubility

WLOGP
0.53
MLOGP
0.45
XLogP3
0.4
Consensus LogP
0.46
Log S (ESOL)
-0.71
Class (ESOL)
Very soluble
Log S (Ali)
-0.91
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.23
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)
-3.07

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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