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CAS 35447-99-5 Bicyclo[4.2.0]octane-1,3,5-triene-7-ol molecular structure lightbox
CAS RN: 35447-99-5

Bicyclo[4.2.0]octane-1,3,5-triene-7-ol

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260325 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-142444
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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: ＞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 35447-99-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

35447-99-5 / bicyclo[4.2.0]octa-1,3,5-trien-7-ol

Standard CAS: 35447-99-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
35447-99-5
Multi CAS
Yes
Molecular Formula
C8H8O
Molecular Weight
120.150000
Exact Mass
120.057515
InChI
InChI=1S/C8H8O/c9-8-5-6-3-1-2-4-7(6)8/h1-4,8-9H,5H2
InChIKey
SKLKSDFOCXHYOO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
Fraction Csp3
0.25
H-bond acceptors
1
H-bond donors
1
Molar refractivity
35.11
TPSA
20.23

LogP / Solubility

WLOGP
1.28
MLOGP
1.11
XLogP3
0.7
Consensus LogP
1.03
Log S (ESOL)
-1.88
Class (ESOL)
Soluble
Log S (Ali)
-1.47
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.5
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)
-2.55

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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