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CAS 61477-39-2 (S)-3-Aminobutan-1ol molecular structure lightbox
CAS RN: 61477-39-2

(S)-3-Aminobutan-1ol

  • Product code: SSC-170375
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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, 100g
  • Available purity: ≥98%
  • Inventory rows with stock: 1
  • 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 61477-39-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 3 In Stock Hong Kong Inquiry
5g ≥98% 0 Out of Stock Shenzhen Inquiry
10g ≥98% 0 Out of Stock Hong Kong Inquiry
25g ≥98% 0 Out of Stock Hong Kong Inquiry
100g ≥98% 0 Out of Stock Shanghai Inquiry

61477-39-2 / (3R)-3-aminobutan-1-ol

Standard CAS: 61477-39-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
61477-39-2
Multi CAS
Yes
Molecular Formula
C4H11NO
Molecular Weight
89.140000
Exact Mass
89.084064
InChI
InChI=1S/C4H11NO/c1-4(5)2-3-6/h4,6H,2-3,5H2,1H3/t4-/m0/s1
InChIKey
AGMZSYQMSHMXLT-BYPYZUCNSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
25.35
TPSA
46.25

LogP / Solubility

WLOGP
-0.28
MLOGP
-0.26
XLogP3
-0.6
Consensus LogP
-0.38
Log S (ESOL)
-0.08
Class (ESOL)
Very soluble
Log S (Ali)
-0.09
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.24
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)
-3.47

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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