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CAS 2163-34-0 4-TERT-BUTYLCYCLOHEXANAMINE molecular structure lightbox
CAS RN: 2163-34-0

4-TERT-BUTYLCYCLOHEXANAMINE

  • Product code: SSC-103648
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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 2163-34-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

2163-34-0 / 4-tert-butylcyclohexan-1-amine

Standard CAS: 2163-34-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2163-34-0
Multi CAS
No
Molecular Formula
C10H21N
Molecular Weight
155.280000
Exact Mass
155.167400
SMILES
CC(C)(C)C1CCC(CC1)N
InChI
InChI=1S/C10H21N/c1-10(2,3)8-4-6-9(11)7-5-8/h8-9H,4-7,11H2,1-3H3
InChIKey
BGNLXETYTAAURD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
49.39
TPSA
26.02

LogP / Solubility

WLOGP
2.55
MLOGP
2.24
XLogP3
2.8
Consensus LogP
2.53
Log S (ESOL)
-2.41
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.67
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.79
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)
-1.86

Drug-likeness / Medicinal Chemistry

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

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