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CAS 1038594-01-2 (R)-2-AMino-1-(pyridin-3-yl)ethanol hydrochloride molecular structure lightbox
CAS RN: 1038594-01-2

(R)-2-AMino-1-(pyridin-3-yl)ethanol hydrochloride

Product Availability

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3 package records0 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260121 100mg Out of stock Inquiry
Batchno.20260203 1g Out of stock Inquiry
Batchno.20250517 250mg Out of stock Inquiry
  • Product code: SSC-005494
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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: 1g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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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 1038594-01-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

1038594-01-2 / (1R)-2-amino-1-pyridin-3-ylethanol;hydrochloride

(R)-2-Amino-1-(pyridin-3-yl)ethanol hydrochloride | MFCD18427769 | (1R)-2-amino-1-pyridin-3-ylethanol;hydrochloride

Standard CAS: 1038594-01-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1038594-01-2
Multi CAS
Yes
Molecular Formula
C7H11ClN2O
Molecular Weight
174.630000
Exact Mass
174.055991
SMILES
C1=CC(=CN=C1)[C@H](CN)O.Cl
InChI
InChI=1S/C7H10N2O.ClH/c8-4-7(10)6-2-1-3-9-5-6;/h1-3,5,7,10H,4,8H2;1H/t7-;/m0./s1
InChIKey
PMVFSIPPTOOMTI-FJXQXJEOSA-N
Synonyms
(R)-2-Amino-1-(pyridin-3-yl)ethanol hydrochloride MFCD18427769 (1R)-2-amino-1-pyridin-3-ylethanol;hydrochloride (R)-2-AMINO-1-(PYRIDIN-3-YL)ETHANOL HCL (R)-2-Amino-1-(pyridin-3-yl)ethanolhydrochloride

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.29
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
45.5
TPSA
59.14

LogP / Solubility

WLOGP
0.5
MLOGP
0.43
XLogP3
0.5
Consensus LogP
0.48
Log S (ESOL)
-1.51
Class (ESOL)
Soluble
Log S (Ali)
-1.35
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.45
Class (SILICOS-IT)
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)
-3.43

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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