[email protected]
CAS 371784-53-1 Cyclobutanecarboxaldehyde, 2-[(acetyloxy)methyl]-, (1R,2R)- (9CI) molecular structure lightbox
CAS RN: 371784-53-1

Cyclobutanecarboxaldehyde, 2-[(acetyloxy)methyl]-, (1R,2R)- (9CI)

  • Product code: SSC-144504
GET A QUOTE
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: >90%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 371784-53-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >90% 2 In Stock Shanghai Inquiry
0.25g >90% 2 In Stock Shenzhen Inquiry
1g >90% 2 In Stock Shenzhen Inquiry

371784-53-1 / [(1R,2R)-2-formylcyclobutyl]methyl acetate

Standard CAS: 371784-53-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
371784-53-1
Multi CAS
Yes
Molecular Formula
C8H12O3
Molecular Weight
156.180000
Exact Mass
156.078644
InChI
InChI=1S/C8H12O3/c1-6(10)11-5-8-3-2-7(8)4-9/h4,7-8H,2-3,5H2,1H3/t7-,8-/m0/s1
InChIKey
OYQHJCMXKSAHIL-YUMQZZPRSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.75
Rotatable bonds
3
H-bond acceptors
3
Molar refractivity
38.91
TPSA
43.37

LogP / Solubility

WLOGP
0.77
MLOGP
0.68
XLogP3
0.3
Consensus LogP
0.58
Log S (ESOL)
-1.1
Class (ESOL)
Soluble
Log S (Ali)
-1.4
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.68
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)
-3.12

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
2.5

Customers Also Viewed

Get In Touch

Contact Us