[email protected]
CAS 131023-37-5 4-CHLOROACETYL-2,7-DICHLOROFLUORENE molecular structure lightbox
CAS RN: 131023-37-5

4-CHLOROACETYL-2,7-DICHLOROFLUORENE

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260603 1g In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250803 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251008 250mg / 1g / 5g Confirm by inquiry Shanghai, Shandong Inquiry
Batchno.20260111 5g In stock Shanghai Inquiry
  • Product code: starshine_CAS131023-37-5
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

131023-37-5 / 2-chloro-1-(2,7-dichloro-9H-fluoren-4-yl)ethanone

Standard CAS: 131023-37-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
131023-37-5
Multi CAS
No
Molecular Formula
C15H9Cl3O
Molecular Weight
311.600000
Exact Mass
309.971898
SMILES
C1C2=C(C=CC(=C2)Cl)C3=C1C=C(C=C3C(=O)CCl)Cl
InChI
InChI=1S/C15H9Cl3O/c16-7-14(19)13-6-11(18)5-9-3-8-4-10(17)1-2-12(8)15(9)13/h1-2,4-6H,3,7H2
InChIKey
FUSJWQRNFMDEGH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
12
Fraction Csp3
0.13
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
79.75
TPSA
17.07

LogP / Solubility

WLOGP
4.99
MLOGP
4.4
XLogP3
5.1
Consensus LogP
4.83
Log S (ESOL)
-5.25
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.72
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.06
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.08

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us