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CAS 33788-00-0 6-Undecanamine molecular structure lightbox
CAS RN: 33788-00-0

6-Undecanamine

Product Availability

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6 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250112 1ml / 5ml / 25ml Confirm by inquiry Shandong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251124 100g Out of stock Inquiry
Batchno.20250620 1g In stock Shanghai Inquiry
Batchno.20260608 250mg In stock Shanghai, Chengdu Inquiry
Batchno.20250718 25g In stock Shanghai Inquiry
Batchno.20250109 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
  • Product code: ICTU0094
  • Purity/Analytical Methods: >97.0%(T)
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33788-00-0 / undecan-6-amine

Standard CAS: 33788-00-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
33788-00-0
Multi CAS
No
Molecular Formula
C11H25N
Molecular Weight
171.320000
Exact Mass
171.198700
InChI
InChI=1S/C11H25N/c1-3-5-7-9-11(12)10-8-6-4-2/h11H,3-10,12H2,1-2H3
InChIKey
GFBRYGJZWXLRFR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
1
Rotatable bonds
8
H-bond acceptors
1
H-bond donors
1
Molar refractivity
56.26
TPSA
26.02

LogP / Solubility

WLOGP
3.47
MLOGP
3.05
XLogP3
4
Consensus LogP
3.51
Log S (ESOL)
-2.56
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.47
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.62
Class (SILICOS-IT)
Slightly 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)
-1.3

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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