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[2-(Dimethylamino)ethyl]benzyl-2-pyridylamine, chloride

HCID 43833334
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Basic information

CAS
154-69-8
Standard SMILES
C[NH+](C)CCN(Cc1ccccc1)c1ccccn1.[Cl-]
InChIKey
FSSICIQKZGUEAE-UHFFFAOYSA-N
Molecular formula
C16H22ClN3
Average molar mass
291.82 g/mol
Monoisotopic mass
291.1502254

Overview

See also: Tripelennamine Hydrochloride (preferred); Tripelennamine (has active moiety); Tripelennamine Citrate (related).

Names & identifiers

Preferred name
[2-(Dimethylamino)ethyl]benzyl-2-pyridylamine, chloride
IUPAC
2-[benzyl(pyridin-2-yl)amino]ethyl-dimethylazanium chloride
English name
Tripelennamine hydrochloride
Molecular formula
C16H22ClN3
Molecular weight
291.82

Names & synonyms

SBB056873AKOS025116925[2-(dimethylamino)ethyl]benzyl-2-pyridylamine, chlorideAzaronTripyridamole hydrochlorideTRIPELENNAMINE HCLReCovrdehistinpiristinAhistaminpyrinaminestanzamine
Show more names
tri-tumine

Database identifiers

CAS
154-69-8
PubChem CID
43833334

Properties

Computed structural properties

Topological polar surface area
20.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
20
Formal charge
0
Complexity
236

Physicochemical properties

Melting point
192 · 192-193℃
Density
1.2 · 1.20
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
solubility
25 mg/mL · DMSO : 25 mg/mL (85.67 mM; Need ultrasonic)
form
Solid
color
White to off-white
Major Application
cleaning productscosmeticsfood and beveragesforensics and toxicologypersonal carepharmaceutical (small molecule)veterinary
InChI
InChI=1S/C16H21N3.ClH/c1-18(2)12-13-19(16-10-6-7-11-17-16)14-15-8-4-3-5-9-15;/h3-11H,12-14H2,1-2H3;1H
InChIKey
FSSICIQKZGUEAE-UHFFFAOYSA-N
SMILES
N(CCN(C)C)(CC1=CC=CC=C1)C1=NC=CC=C1.Cl
FDA UNII
8 GJ56ZN · FWV8GJ56ZN
EPA Substance Registry System
Tripelennamine hydrochloride (154-69-8)
UNSPSC Code
41116107 · 41116107
NACRES
24 · NA.24
Symbol(GHS)
7 · GHS07

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

PPE
dust mask type N95 (US), Eyeshields, Faceshields, Gloves
wgk
3
rtecs
US3150000
hs_code
2933399090
Toxicity
LD50 in mice (mg/kg): 47 i.p. (Walker)
risk_code
22-36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xn
safety_code
26-36
Storage Class
11 - Combustible Solids
target organs
Respiratory system
Hazard statements
H302-H315-H319-H335
Hazard Classifications
Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements
P261-P264-P270-P301+P312-P302+P352-P305+P351+P338

Chemistry & industry

Applications · 4 items

UsesTripelennamine is a first-generation antihistamine, used in the treatment of asthma, hay fever, and urticaria.

Usesantihistaminic;histamine H1 antagonist

General DescriptionTripelennamine hydrochlorideis a white crystalline powder that darkensslowly on exposure to light. The salt is soluble in water(1:0.77) and in alcohol (1:6). It has a pKa of about 9, and a0.1% solution has a pH of about 5.5.Tripelennamine, the first ethylenediamine developed inthe United States and is well absorbed when given orally. Itappears to be as effective as diphenhydramine and may havethe advantage of fewer and less severe side reactions.Drowsiness may occur, however, and may impair the abilityto perform tasks requiring alertness. The concurrent use ofalcoholic beverages should be avoided.

General DescriptionOdorless white crystalline powder or solid. Bitter taste. Solutions are neutral to litmus. pH of aqueous solution (25 mg/mL): 6.71. pH of aqueous solution (50 mg/mL): 6.67. pH of aqueous solution (100 mg/mL): 5.56.

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
More actions
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Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P264-P270-P301+P312-P302+P352-P305+P351+P338
target organs
Respiratory system
PPE
95 · dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Hazard Codes
Xn
Risk Statements
22 · 22-36/37/38
Safety Statements
26 · 26-36
WGK Germany
3 · 3
RTECS
3150000 · US3150000
HS Code
2933399090 · 2933399090
Storage Class
11 · 11 - Combustible Solids
Hazard Classifications
4 OralEye · Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
Toxicity
50 in · LD50 in mice (mg/kg): 47 i.p. (Walker)