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CAS 935288-20-3 1-broMo-4-fluoro-2-Methoxy-5-nitrobenzene molecular structure lightbox
CAS RN: 935288-20-3

1-broMo-4-fluoro-2-Methoxy-5-nitrobenzene

  • Product code: SSC-207803
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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, 5g, 10g, 25g, 100g
  • Available purity: >97%
  • Inventory rows with stock: 4
  • 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 935288-20-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 5 In Stock Shanghai Inquiry
1g >97% 5 In Stock Shenzhen Inquiry
0.25g -- 2 In Stock Shenzhen Inquiry
0.25g >97% 2 In Stock Beijing Inquiry
5g -- 0 Out of Stock Shanghai Inquiry
5g >97% 0 Out of Stock Shanghai Inquiry
10g -- 0 Out of Stock Hong Kong Inquiry
10g >97% 0 Out of Stock Shenzhen Inquiry
25g -- 0 Out of Stock Beijing Inquiry
25g >97% 0 Out of Stock Beijing Inquiry
100g -- 0 Out of Stock Shanghai Inquiry
100g >97% 0 Out of Stock Beijing Inquiry

935288-20-3 / 1-bromo-4-fluoro-2-methoxy-5-nitrobenzene

Standard CAS: 935288-20-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
935288-20-3
Multi CAS
No
Molecular Formula
BC7H5NO3Rf
Molecular Weight
250.020000
Exact Mass
248.943680
InChI
InChI=1S/C7H5BrFNO3/c1-13-7-3-5(9)6(10(11)12)2-4(7)8/h2-3H,1H3
InChIKey
GTIYDLQTZFEZEA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
47.31
TPSA
52.37

LogP / Solubility

WLOGP
2.51
MLOGP
2.21
XLogP3
2.5
Consensus LogP
2.41
Log S (ESOL)
-3.18
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.42
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.6
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.47

Drug-likeness / Medicinal Chemistry

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

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