[email protected]
CAS 1201194-56-0 2-(5-Methylpyridin-2-yl)acetic acid hydrochloride molecular structure lightbox
CAS RN: 1201194-56-0

2-(5-Methylpyridin-2-yl)acetic acid hydrochloride

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251213 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-020909
GET A QUOTE
Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1201194-56-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Hong Kong Inquiry

1201194-56-0 / 2-(5-methyl-2-pyridinyl)acetic acid;hydrochloride

2-(5-Methylpyridin-2-yl)acetic acid hydrochloride | MFCD18802336 | 2-Pyridineacetic acid, 5-methyl-, hydrochloride (1:1)

Standard CAS: 1201194-56-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1201194-56-0
Multi CAS
No
Molecular Formula
C8H10ClNO2
Molecular Weight
187.620000
Exact Mass
187.040006
SMILES
CC1=CN=C(C=C1)CC(=O)O.Cl
InChI
InChI=1S/C8H9NO2.ClH/c1-6-2-3-7(9-5-6)4-8(10)11;/h2-3,5H,4H2,1H3,(H,10,11);1H
InChIKey
IEOUNGZMWIVCJJ-UHFFFAOYSA-N
Synonyms
2-(5-Methylpyridin-2-yl)acetic acid hydrochloride MFCD18802336 2-Pyridineacetic acid, 5-methyl-, hydrochloride (1:1) 2-(5-Methylpyridin-2-yl)acetic acid HCl 2-(5-methyl-2-pyridyl)acetic acid;hydrochloride

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
47.56
TPSA
50.19

LogP / Solubility

WLOGP
1.44
MLOGP
1.26
XLogP3
1.44
Consensus LogP
1.38
Log S (ESOL)
-2.15
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.14
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.31
Class (SILICOS-IT)
Moderately 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)
-2.84

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us