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CAS 3777-69-3 2-Pentylfuran molecular structure lightbox
CAS RN: 3777-69-3

2-Pentylfuran

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260605 10g In stock Shanghai, Shandong, Hebei Inquiry
Batchno.20250328 250g In stock Shandong Inquiry
Batchno.20250618 2g In stock Shanghai, Shandong, Chongqing, Hebei Inquiry
Batchno.20260617 50g In stock Guangdong Inquiry
  • Product code: SSC-145201
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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 3777-69-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥98% 0 Out of Stock Hong Kong Inquiry

3777-69-3 / 2-pentylfuran

Standard CAS: 3777-69-3 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
3777-69-3
Multi CAS
No
Molecular Formula
C9H14O
Molecular Weight
138.210000
Exact Mass
138.104465
InChI
InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3
InChIKey
YVBAUDVGOFCUSG-UHFFFAOYSA-N

Physical Properties

Boiling Point
64.00 to 66.00 °C. @ 23.00 mm Hg
Density
0.886-0.893
Physical Description
Colorless liquid; Colourless liquid; Fruity aroma
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.56
Rotatable bonds
4
H-bond acceptors
1
Molar refractivity
41.94
TPSA
13.14

LogP / Solubility

WLOGP
3.01
MLOGP
2.64
XLogP3
3.7
Consensus LogP
3.12
Log S (ESOL)
-2.7
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.87
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.54
Class (SILICOS-IT)
Poorly 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)
-1.42

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

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