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CAS 66164-10-1 1-Propanol, 3-aMino-2-Methyl-, hydrochloride molecular structure lightbox
CAS RN: 66164-10-1

1-Propanol, 3-aMino-2-Methyl-, hydrochloride

  • Product code: SSC-175803
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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: ≥95%
  • 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 66164-10-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

66164-10-1 / 3-amino-2-methylpropan-1-ol;hydrochloride

Standard CAS: 66164-10-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
66164-10-1
Multi CAS
No
Molecular Formula
C4H12CLNO
Molecular Weight
125.600000
Exact Mass
125.060742
InChI
InChI=1S/C4H11NO.ClH/c1-4(2-5)3-6;/h4,6H,2-3,5H2,1H3;1H
InChIKey
SZPCMDISHYFOHA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
32.55
TPSA
46.25

LogP / Solubility

MLOGP
-0.01
Consensus LogP
0.0000
Log S (ESOL)
-0.48
Class (ESOL)
Very soluble
Log S (Ali)
-0.59
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.71
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)
-3.49

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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