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CAS 10354-00-4 DIBENZOSUBERENOL molecular structure lightbox
CAS RN: 10354-00-4

DIBENZOSUBERENOL

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250511 1g / 5g / 25g Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-005120
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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: 5g
  • 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 10354-00-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Beijing Inquiry

10354-00-4 / tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaen-2-ol

Dibenzosuberenol | 5H-Dibenzo[a,d]cyclohepten-5-ol | 5H-Dibenzo(a,d)cyclohepten-5-ol

Standard CAS: 10354-00-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
10354-00-4
Multi CAS
Yes
Molecular Formula
C15H12O
Molecular Weight
208.250000
Exact Mass
208.088815
SMILES
C1=CC=C2C(C3=CC=CC=C3C=CC2=C1)O
InChI
InChI=1S/C15H12O/c16-15-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)15/h1-10,15-16H
InChIKey
SRIISEYIFDTFRZ-UHFFFAOYSA-N
Synonyms
Dibenzosuberenol 5H-Dibenzo[a,d]cyclohepten-5-ol 5H-Dibenzo(a,d)cyclohepten-5-ol UNII-S9T01JBH4A S9T01JBH4A

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
12
Fraction Csp3
0.07
H-bond acceptors
1
H-bond donors
1
Molar refractivity
65.87
TPSA
20.23

LogP / Solubility

WLOGP
3.25
MLOGP
2.86
XLogP3
3.2
Consensus LogP
3.1
Log S (ESOL)
-3.74
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.62
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.71
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.68

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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