CAS RN: 115652-52-3
1-Amino-1-(hydroxymethyl)cyclopropane hydrochloride
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
- Product code: SSC-015415
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, 0.25g, 100g
- Available purity: ≥98%
- Inventory rows with stock: 5
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥98% | 5 In Stock | Beijing | Inquiry |
| 5g | ≥98% | 5 In Stock | Shanghai | Inquiry |
| 10g | ≥98% | 4 In Stock | Beijing | Inquiry |
| 25g | ≥98% | 4 In Stock | Beijing | Inquiry |
| 0.25g | ≥98% | 2 In Stock | Shanghai | Inquiry |
| 100g | ≥98% | 0 Out of Stock | Beijing | Inquiry |
115652-52-3 / (1-aminocyclopropyl)methanol;hydrochloride
(1-aminocyclopropyl)methanol hydrochloride | RefChem:392004 | 808-869-5
Basic Information
CAS
115652-52-3
Multi CAS
Yes
Molecular Formula
C4H10ClNO
Molecular Weight
123.580000
Exact Mass
123.045092
SMILES
C1CC1(CO)N.Cl
InChI
InChI=1S/C4H9NO.ClH/c5-4(3-6)1-2-4;/h6H,1-3,5H2;1H
InChIKey
ULEMJGCUGKDKTD-UHFFFAOYSA-N
Synonyms
(1-aminocyclopropyl)methanol hydrochloride
RefChem:392004
808-869-5
1-Aminocyclopropanemethanol hydrochloride
MFCD09834330
Computed Properties
Structural Parameters
Heavy atom count
7
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
30.49
TPSA
46.25
LogP / Solubility
WLOGP
-0.11
MLOGP
-0.1
XLogP3
-0.11
Consensus LogP
-0.11
Log S (ESOL)
-0.47
Class (ESOL)
Very soluble
Log S (Ali)
-0.5
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.49
Class (SILICOS-IT)
Very 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)
-3.55
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H319 (97.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264+P265, P280, P305+P351+P338, and P337+P317
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