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CAS 111795-43-8 (R)-3,3′-Dibromo-1,1′-bi-2-naphthol molecular structure lightbox
CAS RN: 111795-43-8

(R)-3,3′-Dibromo-1,1′-bi-2-naphthol

Product Availability

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2 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250921 250mg / 1g / 5g Confirm by inquiry Shanghai 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250326 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-012312
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 5g, 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 8
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 111795-43-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g -- 5 In Stock Shenzhen Inquiry
0.1g ≥95% 5 In Stock Beijing Inquiry
0.25g -- 5 In Stock Beijing Inquiry
0.25g ≥95% 5 In Stock Hong Kong Inquiry
5g -- 3 In Stock Beijing Inquiry
5g ≥95% 3 In Stock Hong Kong Inquiry
1g -- 1 In Stock Beijing Inquiry
1g ≥95% 1 In Stock Shenzhen Inquiry

111795-43-8 / 3-bromo-1-(3-bromo-2-hydroxynaphthalen-1-yl)naphthalen-2-ol

(S)-3,3'-Dibromo-1,1'-bi-2-naphthol | (R)-3,3'-Dibromo-1,1'-bi-2-naphthol | RefChem:407243

Standard CAS: 111795-43-8 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
111795-43-8
Multi CAS
Yes
Molecular Formula
C20H12Br2O2
Molecular Weight
444.100000
Exact Mass
443.918360
SMILES
C1=CC=C2C(=C1)C=C(C(=C2C3=C(C(=CC4=CC=CC=C43)Br)O)O)Br
InChI
InChI=1S/C20H12Br2O2/c21-15-9-11-5-1-3-7-13(11)17(19(15)23)18-14-8-4-2-6-12(14)10-16(22)20(18)24/h1-10,23-24H
InChIKey
BRTBEAXHUYEXSY-UHFFFAOYSA-N
Synonyms
(S)-3,3'-Dibromo-1,1'-bi-2-naphthol (R)-3,3'-Dibromo-1,1'-bi-2-naphthol RefChem:407243 622-543-8 623-768-4

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
20
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
105.62
TPSA
40.46

LogP / Solubility

WLOGP
6.6
MLOGP
5.83
XLogP3
6.7
Consensus LogP
6.38
Log S (ESOL)
-7.3
Class (ESOL)
Insoluble
Log S (Ali)
-7.96
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.14
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)
-0.75

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant Environmental Hazard
Signal
Warning
GHS Hazard Statements
H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H400 (66.7%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] H410 (66.7%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P391, and P501

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