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CAS 742103-27-1 Di-t-butyl(2,2-diphenyl-1-methylcyclopropyl)phosphinecBRIDP molecular structure lightbox
CAS RN: 742103-27-1

Di-t-butyl(2,2-diphenyl-1-methylcyclopropyl)phosphinecBRIDP

  • Product code: SSC-183673
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 742103-27-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 0 Out of Stock Shenzhen Inquiry

742103-27-1 / ditert-butyl-(1-methyl-2,2-diphenylcyclopropyl)phosphane

Standard CAS: 742103-27-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
742103-27-1
Multi CAS
No
Molecular Formula
C24H33P
Molecular Weight
352.500000
Exact Mass
352.231988
InChI
InChI=1S/C24H33P/c1-21(2,3)25(22(4,5)6)23(7)18-24(23,19-14-10-8-11-15-19)20-16-12-9-13-17-20/h8-17H,18H2,1-7H3
InChIKey
QMLPJDVGNRHGJQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
12
Fraction Csp3
0.5
Rotatable bonds
3
Molar refractivity
113.11
TPSA
0.0000

LogP / Solubility

WLOGP
7.21
MLOGP
6.37
XLogP3
5.7
Consensus LogP
6.43
Log S (ESOL)
-6.73
Class (ESOL)
Insoluble
Log S (Ali)
-7.66
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.3
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.25

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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