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CAS 111-18-2 N,N,N’,N’-Tetramethyl-1,6-diaminohexane molecular structure lightbox
CAS RN: 111-18-2

N,N,N’,N’-Tetramethyl-1,6-diaminohexane

Product Availability

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6 package records6 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250531 100ml In stock Inquiry
Batchno.20250821 10L In stock Inquiry
Batchno.20250102 2.5L In stock Inquiry
Batchno.20250108 25ml In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250219 25ml / 100ml / 500ml / 2.5L / 10L Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250501 5ml In stock Shanghai Inquiry
  • Product code: SSC-011879
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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: 500g
  • Available purity: ≥97%
  • 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 111-18-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
500g ≥97% 0 Out of Stock Shenzhen Inquiry

111-18-2 / N,N,N',N'-tetramethylhexane-1,6-diamine

1,6-Bis(dimethylamino)hexane | Hexamethylenebis(dimethylamine) | tetramethylhexamethylenediamine

Standard CAS: 111-18-2 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
111-18-2
Multi CAS
Yes
Molecular Formula
C10H24N2
Molecular Weight
172.310000
Exact Mass
172.193949
SMILES
CN(C)CCCCCCN(C)C
InChI
InChI=1S/C10H24N2/c1-11(2)9-7-5-6-8-10-12(3)4/h5-10H2,1-4H3
InChIKey
TXXWBTOATXBWDR-UHFFFAOYSA-N
Synonyms
1,6-Bis(dimethylamino)hexane Hexamethylenebis(dimethylamine) tetramethylhexamethylenediamine 1,6-HEXANEDIAMINE, N,N,N',N'-TETRAMETHYL- Toyocat MR

Physical Properties

Physical Description
Liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
1
Rotatable bonds
7
H-bond acceptors
2
Molar refractivity
55.58
TPSA
6.48

LogP / Solubility

WLOGP
1.67
MLOGP
1.47
XLogP3
1.7
Consensus LogP
1.61
Log S (ESOL)
-1.5
Class (ESOL)
Soluble
Log S (Ali)
-2.18
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.01
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)
-2.59

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 Acute Toxic Irritant Health Hazard Environmental Hazard
Signal
Danger Warning
GHS Hazard Statements
H301+H311+H331 (23.9%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation] H301+H311 (14.4%): Toxic if swallowed or in contact with skin [Danger Acute toxicity, oral; acute toxicity, dermal] H301 (88.3%): Toxic if swallowed [Danger Acute toxicity, oral] H302 (11.7%): Harmful if swallowed [Warning Acute toxicity, oral] H311 (81.4%): Toxic in contact with skin [Danger Acute toxicity, dermal]
Precautionary Statement Codes
P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P284, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P320, P321, P330, P361+P364, P363, P391, P403+P233, P405, and P501 P210, P273, P280, P370+P378, P403, and P501

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