[email protected]
CAS 1352214-46-0 (5-Bromo-2-fluoro-phenyl)-dimethyl-amine molecular structure lightbox
CAS RN: 1352214-46-0

(5-Bromo-2-fluoro-phenyl)-dimethyl-amine

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251203 100mg / 1g Out of stock 15 business days Inquiry
  • Product code: SSC-043201
GET A QUOTE
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: 5g, 10g, 1g, 0.1g, 0.25g, 25g
  • Available purity: ≥97%
  • Inventory rows with stock: 6
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 1352214-46-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥97% 4 In Stock Hong Kong Inquiry
10g ≥97% 3 In Stock Shanghai Inquiry
1g ≥97% 2 In Stock Shenzhen Inquiry
0.1g ≥97% 1 In Stock Shanghai Inquiry
0.25g ≥97% 1 In Stock Hong Kong Inquiry
25g ≥97% 1 In Stock Shanghai Inquiry

1352214-46-0 / 5-bromo-2-fluoro-N,N-dimethylaniline

Standard CAS: 1352214-46-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1352214-46-0
Multi CAS
No
Molecular Formula
C8H9BrFN
Molecular Weight
218.070000
Exact Mass
216.990240
SMILES
CN(C)C1=C(C=CC(=C1)Br)F
InChI
InChI=1S/C8H9BrFN/c1-11(2)8-5-6(9)3-4-7(8)10/h3-5H,1-2H3
InChIKey
JTBIRMMMLPXWRI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
48.43
TPSA
3.24

LogP / Solubility

WLOGP
2.65
MLOGP
2.34
XLogP3
2.8
Consensus LogP
2.6
Log S (ESOL)
-3.2
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.26
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.4
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)
-2.17

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us