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CAS 1864058-93-4 3,7-DibroMo-6-hydroxy-2-naphthyl Acetate molecular structure lightbox
CAS RN: 1864058-93-4

3,7-DibroMo-6-hydroxy-2-naphthyl Acetate

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260615 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-086490
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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: 1g, 0.25g, 0.1g
  • Available purity: ≥95%
  • Inventory rows with stock: 2
  • 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 1864058-93-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 3 In Stock Shanghai Inquiry
0.25g ≥95% 1 In Stock Hong Kong Inquiry
0.1g ≥95% 0 Out of Stock Shenzhen Inquiry

1864058-93-4 / (3,7-dibromo-6-hydroxynaphthalen-2-yl) acetate

Standard CAS: 1864058-93-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1864058-93-4
Multi CAS
No
Molecular Formula
C12H8Br2O3
Molecular Weight
360.000000
Exact Mass
359.881970
SMILES
CC(=O)OC1=CC2=CC(=C(C=C2C=C1Br)O)Br
InChI
InChI=1S/C12H8Br2O3/c1-6(15)17-12-5-8-2-9(13)11(16)4-7(8)3-10(12)14/h2-5,16H,1H3
InChIKey
OWBFXRUWPRPNTD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
10
Fraction Csp3
0.08
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
72.32
TPSA
46.53

LogP / Solubility

WLOGP
4
MLOGP
3.54
XLogP3
4
Consensus LogP
3.85
Log S (ESOL)
-4.96
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.4
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.44
Class (SILICOS-IT)
Slightly soluble

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
Yes
Log Kp (skin permeation)
-2.08

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

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