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CAS 30169-71-2 2-BUTYL-1,3,2-DIOXABORINANE molecular structure lightbox
CAS RN: 30169-71-2

2-BUTYL-1,3,2-DIOXABORINANE

Product Availability

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250107 1g In stock Shanghai Inquiry
Batchno.20260228 1g / 5g / 50g Out of stock 5-7 business days Inquiry
Batchno.20260624 250mg In stock Shanghai Inquiry
Batchno.20260401 25g In stock Shanghai Inquiry
Batchno.20260107 5g In stock Shanghai Inquiry
  • Product code: starshine_CAS30169-71-2
  • Purity/Analytical Methods: >99.0%
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30169-71-2 / 2-butyl-1,3,2-dioxaborinane

Standard CAS: 30169-71-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
30169-71-2
Multi CAS
Yes
Molecular Formula
BC7H15O2
Molecular Weight
142.010000
Exact Mass
142.116510
InChI
InChI=1S/C7H15BO2/c1-2-3-5-8-9-6-4-7-10-8/h2-7H2,1H3
InChIKey
UDMVQMMUSQGSDO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
41.99
TPSA
18.46

LogP / Solubility

WLOGP
1.71
MLOGP
1.5
XLogP3
1.71
Consensus LogP
1.64
Log S (ESOL)
-1.6
Class (ESOL)
Soluble
Log S (Ali)
-1.96
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.36
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)
-2.37

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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