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CAS 22090-26-2 1-(4-Bromophenyl)pyrrolidine molecular structure lightbox
CAS RN: 22090-26-2

1-(4-Bromophenyl)pyrrolidine

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260226 250mg / 1g / 5g / 25g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-106268
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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, 5g, 10g, 25g
  • Available purity: ≥98%
  • Inventory rows with stock: 6
  • 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 22090-26-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 4 In Stock Shenzhen Inquiry
5g -- 4 In Stock Shenzhen Inquiry
5g ≥98% 3 In Stock Shanghai Inquiry
10g ≥98% 3 In Stock Shenzhen Inquiry
10g -- 2 In Stock Hong Kong Inquiry
1g ≥98% 1 In Stock Beijing Inquiry
25g -- 0 Out of Stock Beijing Inquiry
25g ≥98% 0 Out of Stock Shenzhen Inquiry

22090-26-2 / 1-(4-bromophenyl)pyrrolidine

Standard CAS: 22090-26-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
22090-26-2
Multi CAS
No
Molecular Formula
C10H12BrN
Molecular Weight
226.110000
Exact Mass
225.015310
SMILES
C1CCN(C1)C2=CC=C(C=C2)Br
InChI
InChI=1S/C10H12BrN/c11-9-3-5-10(6-4-9)12-7-1-2-8-12/h3-6H,1-2,7-8H2
InChIKey
BVEGBJXZICCEQW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
55.59
TPSA
3.24

LogP / Solubility

WLOGP
3.05
MLOGP
2.69
XLogP3
4.3
Consensus LogP
3.35
Log S (ESOL)
-3.47
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.62
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.78
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)
-1.93

Drug-likeness / Medicinal Chemistry

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

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