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CAS 1268693-24-8 “4-(anthracen-9-yl)-3-(tertbutyl)-2,3-dihydrobenzo[d][1,3]oxaphosphole” molecular structure lightbox
CAS RN: 1268693-24-8

“4-(anthracen-9-yl)-3-(tertbutyl)-2,3-dihydrobenzo[d][1,3]oxaphosphole”

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250210 100mg In stock Inquiry
Batchno.20250721 1g In stock Inquiry
Batchno.20260308 250mg In stock Inquiry
Batchno.20260526 5g In stock Inquiry
  • Product code: SSC-034135
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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: 0.25g, 1g, 5g, 10g
  • Available purity: ≥95%
  • 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 1268693-24-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Hong Kong Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry
10g ≥95% 0 Out of Stock Shanghai Inquiry

1268693-24-8 / 4-anthracen-9-yl-3-tert-butyl-2H-1,3-benzoxaphosphole

Standard CAS: 1268693-24-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1268693-24-8
Multi CAS
No
Molecular Formula
C25H23OP
Molecular Weight
370.400000
Exact Mass
370.148652
SMILES
CC(C)(C)P1COC2=CC=CC(=C21)C3=C4C=CC=CC4=CC5=CC=CC=C53
InChI
InChI=1S/C25H23OP/c1-25(2,3)27-16-26-22-14-8-13-21(24(22)27)23-19-11-6-4-9-17(19)15-18-10-5-7-12-20(18)23/h4-15H,16H2,1-3H3
InChIKey
HKAWVLHXUZNLPP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
20
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
118.69
TPSA
9.23

LogP / Solubility

WLOGP
6.92
MLOGP
6.11
XLogP3
6.4
Consensus LogP
6.48
Log S (ESOL)
-6.98
Class (ESOL)
Insoluble
Log S (Ali)
-7.59
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.93
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)
-0.07

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
4

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