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CAS 74317-85-4 3-(2-AMINOETHYL)PYRIDINE molecular structure lightbox
CAS RN: 74317-85-4

3-(2-AMINOETHYL)PYRIDINE

  • Product code: SSC-183766
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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: 5g, 1g, 10g, 25g, 100g, 500g
  • Available purity: ≥98%
  • 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 74317-85-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥98% 3 In Stock Hong Kong Inquiry
1g ≥98% 1 In Stock Shenzhen Inquiry
10g ≥98% 0 Out of Stock Shanghai Inquiry
25g ≥98% 0 Out of Stock Shanghai Inquiry
100g ≥98% 0 Out of Stock Beijing Inquiry
500g ≥98% 0 Out of Stock Hong Kong Inquiry

74317-85-4 / 2-bromo-4-methoxybenzoic acid

Standard CAS: 74317-85-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
74317-85-4
Multi CAS
Yes
Molecular Formula
C8H7BRO3
Molecular Weight
231.040000
Exact Mass
229.957860
InChI
InChI=1S/C8H7BrO3/c1-12-5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)
InChIKey
SEJVMKLJNIKFAF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.12
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
47.65
TPSA
46.53

LogP / Solubility

WLOGP
2.16
MLOGP
1.9
XLogP3
2.5
Consensus LogP
2.19
Log S (ESOL)
-2.87
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.01
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.19
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)
-2.6

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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