[email protected]
CAS 13093-05-5 N,N’-Diethyl-1,6-diaminohexane molecular structure lightbox
CAS RN: 13093-05-5

N,N’-Diethyl-1,6-diaminohexane

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260610 1ml / 5ml / 25ml Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-037464
GET A QUOTE
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: 25g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 13093-05-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞97% 0 Out of Stock Beijing Inquiry

13093-05-5 / N,N'-diethylhexane-1,6-diamine

Standard CAS: 13093-05-5 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
13093-05-5
Multi CAS
No
Molecular Formula
C10H24N2
Molecular Weight
172.310000
Exact Mass
172.193949
SMILES
CCNCCCCCCNCC
InChI
InChI=1S/C10H24N2/c1-3-11-9-7-5-6-8-10-12-4-2/h11-12H,3-10H2,1-2H3
InChIKey
LDQWVRMGQLAWMN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
1
Rotatable bonds
9
H-bond acceptors
2
H-bond donors
2
Molar refractivity
55.56
TPSA
24.06

LogP / Solubility

WLOGP
1.77
MLOGP
1.55
XLogP3
1.5
Consensus LogP
1.61
Log S (ESOL)
-1.43
Class (ESOL)
Soluble
Log S (Ali)
-2.25
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.33
Class (SILICOS-IT)
Poorly 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)
-2.52

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

Safety & Transport

Pictogram(s)
Corrosive
Signal
Danger
GHS Hazard Statements
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement Codes
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501

Customers Also Viewed

Get In Touch

Contact Us