CAS RN: 60633-21-8

DI-T-BUTYLNEOPENTYLPHOSPHINE, MIN. 95

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260122 200mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS60633-21-8
  • Purity/Analytical Methods: >99.0%
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60633-21-8 / ditert-butyl(2,2-dimethylpropyl)phosphane

Standard CAS: 60633-21-8 Multi CAS: Yes

Basic Information

CAS
60633-21-8
Multi CAS
Yes
Molecular Formula
C13H29P
Molecular Weight
216.340000
Exact Mass
216.200688
InChI
InChI=1S/C13H29P/c1-11(2,3)10-14(12(4,5)6)13(7,8)9/h10H2,1-9H3
InChIKey
JBGICSFDKZAWFJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
1
Rotatable bonds
1
Molar refractivity
70.75
TPSA
0.0000

LogP / Solubility

WLOGP
5.11
MLOGP
4.5
XLogP3
3.6
Consensus LogP
4.4
Log S (ESOL)
-4.34
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.02
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.43
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.41

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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