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CAS 1438-94-4 1-Furfurylpyrrole molecular structure lightbox
CAS RN: 1438-94-4

1-Furfurylpyrrole

Product Availability

Choose a grade to view its available package options.

6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250208 1g In stock Shanghai, Shandong, Guangdong Inquiry
Batchno.20251026 25g In stock Shanghai Inquiry
Batchno.20260428 5g In stock Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260514 1g In stock Shanghai Inquiry
Batchno.20251031 25g In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20250319 5g In stock Shanghai, Tianjin, Wuhan Inquiry
  • Product code: SSC-055115
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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: 5g
  • Available purity: ＞97%
  • 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 1438-94-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Hong Kong Inquiry

1438-94-4 / 1-(furan-2-ylmethyl)pyrrole

Standard CAS: 1438-94-4 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1438-94-4
Multi CAS
No
Molecular Formula
C9H9NO
Molecular Weight
147.170000
Exact Mass
147.068414
SMILES
C1=CN(C=C1)CC2=CC=CO2
InChI
InChI=1S/C9H9NO/c1-2-6-10(5-1)8-9-4-3-7-11-9/h1-7H,8H2
InChIKey
BTBFUBUCCJKJOZ-UHFFFAOYSA-N

Physical Properties

Boiling Point
77.00 to 79.00 °C. @ 1.00 mm Hg
Density
1.078-1.084
Physical Description
Liquid Colourless to yellow liquid; Vegetable, earthy-green aroma
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
10
Fraction Csp3
0.11
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
42.24
TPSA
18.07

LogP / Solubility

WLOGP
2.13
MLOGP
1.87
XLogP3
1.4
Consensus LogP
1.8
Log S (ESOL)
-2.63
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.3
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.62
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.11

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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

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