CAS RN: 4333-56-6

Bromocyclopropane

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20251020 100g In stock Inquiry
Batchno.20250904 250g In stock Inquiry
Batchno.20250716 25g In stock Inquiry
Batchno.20260421 500g Out of stock Inquiry
Batchno.20250416 5g In stock Inquiry
  • Product code: ICTC1067
  • Purity/Analytical Methods: >98.0%(GC)
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4333-56-6 / bromocyclopropane

Standard CAS: 4333-56-6 Multi CAS: Yes

Basic Information

CAS
4333-56-6
Multi CAS
Yes
Molecular Formula
C3H5BR
Molecular Weight
120.980000
Exact Mass
119.957460
InChI
InChI=1S/C3H5Br/c4-3-1-2-3/h3H,1-2H2
InChIKey
LKXYJYDRLBPHRS-UHFFFAOYSA-N

Physical Properties

Physical Description
Colorless liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
4
Fraction Csp3
1
Molar refractivity
21.95
TPSA
0.0000

LogP / Solubility

WLOGP
1.54
MLOGP
1.35
XLogP3
1.5
Consensus LogP
1.46
Log S (ESOL)
-1.56
Class (ESOL)
Soluble
Log S (Ali)
-1.67
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.73
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)
-2.36

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

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