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CAS 35120-18-4 Ethyl 1-Bromocyclobutanecarboxylate molecular structure lightbox
CAS RN: 35120-18-4

Ethyl 1-Bromocyclobutanecarboxylate

  • Product code: SSC-141919
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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: 1g, 5g, 10g, 25g, 100g
  • Available purity: ≥96%
  • Inventory rows with stock: 5
  • 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 35120-18-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥96% 5 In Stock Hong Kong Inquiry
5g ≥96% 5 In Stock Shenzhen Inquiry
10g ≥96% 5 In Stock Beijing Inquiry
25g ≥96% 3 In Stock Beijing Inquiry
100g ≥96% 2 In Stock Hong Kong Inquiry

35120-18-4 / ethyl 1-bromocyclobutane-1-carboxylate

Standard CAS: 35120-18-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
35120-18-4
Multi CAS
Yes
Molecular Formula
C7H11BRO2
Molecular Weight
207.060000
Exact Mass
205.994240
InChI
InChI=1S/C7H11BrO2/c1-2-10-6(9)7(8)4-3-5-7/h2-5H2,1H3
InChIKey
UTVNSHXHFRIXMM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.86
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
42.14
TPSA
26.3

LogP / Solubility

WLOGP
1.87
MLOGP
1.64
XLogP3
2
Consensus LogP
1.84
Log S (ESOL)
-2.17
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.61
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)
-2.66

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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