CAS RN: 2501-94-2

T-BUTYLPHOSPHINE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251117 5g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS2501-94-2
  • Purity/Analytical Methods: >99.0%
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2501-94-2 / tert-butylphosphane

Standard CAS: 2501-94-2 Multi CAS: No

Basic Information

CAS
2501-94-2
Multi CAS
No
Molecular Formula
C4H11P
Molecular Weight
90.100000
Exact Mass
90.059837
SMILES
CC(C)(C)P
InChI
InChI=1S/C4H11P/c1-4(2,3)5/h5H2,1-3H3
InChIKey
ZGNPLWZYVAFUNZ-UHFFFAOYSA-N

Physical Properties

Physical Description
Liquid with a stench
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
5
Fraction Csp3
1
Molar refractivity
29.46
TPSA
0.0000

LogP / Solubility

WLOGP
1.66
MLOGP
1.45
XLogP3
0.9
Consensus LogP
1.34
Log S (ESOL)
-1.44
Class (ESOL)
Soluble
Log S (Ali)
-1.5
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.62
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)
-2.09

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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