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CAS 66688-79-7 TRIETHYL-D15-AMINE molecular structure lightbox
CAS RN: 66688-79-7

TRIETHYL-D15-AMINE

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2 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250103 250mg Out of stock 5-7 business days Inquiry
Batchno.20251225 50mg In stock Shanghai Inquiry
  • Product code: starshine_CAS66688-79-7
  • Purity/Analytical Methods: >99.0%
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66688-79-7 / N,N-diethylethanamine

Standard CAS: 66688-79-7 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
66688-79-7
Multi CAS
Yes
Molecular Formula
C6H15N
Molecular Weight
101.190000
Exact Mass
101.120449
InChI
InChI=1S/C6H15N/c1-4-7(5-2)6-3/h4-6H2,1-3H3
InChIKey
ZMANZCXQSJIPKH-UHFFFAOYSA-N

Physical Properties

Melting Point
-174.5 °F (NTP, 1992) -114.7 °C -115 °C -175 °F
Boiling Point
192.7 °F at 760 mmHg (NTP, 1992) 88.8 °C 88.80 to 89.00 °C. @ 760.00 mm Hg 89 °C 193 °F
Density
0.729 at 68 °F (USCG, 1999) - Less dense than water; will float 0.7275 g/cu cm at 20 °C Bulk density: 6.1 lb/gal Saturated liquid density: 45.420 lb/cu ft; liquid heat capacity: 0.556 Btu/lb °F; saturated vapor pressure: 1.084 lb/sq in; saturated vapor density: 0.01930 lb/cu ft (all at 70 °F) Relative density (water = 1): 0.7
Physical Description
Triethylamine appears as a clear colorless liquid with a strong ammonia to fish-like odor. Flash point 20 °F. Vapors irritate the eyes and mucous membranes. Less dense (6.1 lb / gal) than water. Vapors heavier than air. Produces toxic oxides of nitrogen when burned. Liquid Colorless liquid with a strong, ammonia-like odor; [NIOSH] COLOURLESS LIQUID WITH CHARACTERISTIC ODOUR. Colourless to yellowish liquid; Fishy aroma
Appearance
Colorless liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
1
Molar refractivity
33.46
TPSA
3.24

LogP / Solubility

WLOGP
1.35
MLOGP
1.17
XLogP3
1.4
Consensus LogP
1.31
Log S (ESOL)
-1.12
Class (ESOL)
Soluble
Log S (Ali)
-1.36
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.8
Class (SILICOS-IT)
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)
-2.38

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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