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CAS 10267-94-4 Cyclopentene-1-carboxylic acid ethyl ester molecular structure lightbox
CAS RN: 10267-94-4

Cyclopentene-1-carboxylic acid ethyl ester

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250924 100mg / 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-003955
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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: 1g
  • Available purity: ≥95%
  • 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 10267-94-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

10267-94-4 / ethyl cyclopentene-1-carboxylate

ethyl cyclopent-1-enecarboxylate | DTXSID40298323 | RefChem:1085033

Standard CAS: 10267-94-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
10267-94-4
Multi CAS
Yes
Molecular Formula
C8H12O2
Molecular Weight
140.180000
Exact Mass
140.083730
SMILES
CCOC(=O)C1=CCCC1
InChI
InChI=1S/C8H12O2/c1-2-10-8(9)7-5-3-4-6-7/h5H,2-4,6H2,1H3
InChIKey
PHXHZIALCFFYRT-UHFFFAOYSA-N
Synonyms
ethyl cyclopent-1-enecarboxylate DTXSID40298323 RefChem:1085033 DTXCID30249460 Ethyl 1-cyclopentene-1-carboxylate

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.62
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
38.57
TPSA
26.3

LogP / Solubility

WLOGP
1.66
MLOGP
1.45
XLogP3
1.9
Consensus LogP
1.67
Log S (ESOL)
-1.62
Class (ESOL)
Soluble
Log S (Ali)
-1.91
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.19
Class (SILICOS-IT)
Moderately 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)
-2.4

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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