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CAS 463961-43-5 3-(Bromomethyl)cyclobutanone molecular structure lightbox
CAS RN: 463961-43-5

3-(Bromomethyl)cyclobutanone

Product Availability

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4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251130 1g In stock Inquiry
Batchno.20260122 250mg In stock Inquiry
Batchno.20250106 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260412 100mg / 250mg Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-153822
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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, 5g, 10g
  • 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 463961-43-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry
5g ≥95% 0 Out of Stock Hong Kong Inquiry
10g ≥95% 0 Out of Stock Hong Kong Inquiry

463961-43-5 / 3-(bromomethyl)cyclobutan-1-one

Standard CAS: 463961-43-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
463961-43-5
Multi CAS
No
Molecular Formula
C5H7BRO
Molecular Weight
163.010000
Exact Mass
161.968030
InChI
InChI=1S/C5H7BrO/c6-3-4-1-5(7)2-4/h4H,1-3H2
InChIKey
KFXLTMWRAJRYGV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
0.8
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
31.52
TPSA
17.07

LogP / Solubility

WLOGP
1.36
MLOGP
1.19
XLogP3
0.7
Consensus LogP
1.08
Log S (ESOL)
-1.64
Class (ESOL)
Soluble
Log S (Ali)
-1.88
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.97
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)
-2.75

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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