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CAS 31909-58-7 2-FUROYLACETONITRILE molecular structure lightbox
CAS RN: 31909-58-7

2-FUROYLACETONITRILE

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260505 5g / 10g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-137361
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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: 10g
  • 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 31909-58-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ＞97% 0 Out of Stock Shenzhen Inquiry

31909-58-7 / 3-(furan-2-yl)-3-oxopropanenitrile

Standard CAS: 31909-58-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
31909-58-7
Multi CAS
No
Molecular Formula
C7H5NO2
Molecular Weight
135.120000
Exact Mass
135.032028
InChI
InChI=1S/C7H5NO2/c8-4-3-6(9)7-2-1-5-10-7/h1-2,5H,3H2
InChIKey
RZNSHBXVTAHWPP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.14
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
33.27
TPSA
54

LogP / Solubility

WLOGP
1.38
MLOGP
1.2
XLogP3
0.4
Consensus LogP
0.99
Log S (ESOL)
-1.78
Class (ESOL)
Soluble
Log S (Ali)
-1.66
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.92
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)
-2.57

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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