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CAS 56988-04-6 [(2-bromoethoxy)methyl]cyclopropane molecular structure lightbox
CAS RN: 56988-04-6

[(2-bromoethoxy)methyl]cyclopropane

  • Product code: SSC-165056
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g
  • Available purity: >95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 56988-04-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 1 In Stock Hong Kong Inquiry
0.25g >95% 1 In Stock Shanghai Inquiry
1g >95% 1 In Stock Shenzhen Inquiry

56988-04-6 / 2-bromoethoxymethylcyclopropane

Standard CAS: 56988-04-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
56988-04-6
Multi CAS
No
Molecular Formula
C6H11BRO
Molecular Weight
179.050000
Exact Mass
177.999330
InChI
InChI=1S/C6H11BrO/c7-3-4-8-5-6-1-2-6/h6H,1-5H2
InChIKey
NUCYWTUUCLZIPH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
1
Rotatable bonds
4
H-bond acceptors
1
Molar refractivity
37.34
TPSA
9.23

LogP / Solubility

WLOGP
1.81
MLOGP
1.59
XLogP3
1.6
Consensus LogP
1.67
Log S (ESOL)
-1.83
Class (ESOL)
Soluble
Log S (Ali)
-2.33
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.8
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)
-2.53

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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