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25646-71-3

Basic Information
CAS No.: 25646-71-3
Name: 2-[(4-Amino-3-methylphenyl)ethylamino]ethyl sulfate
Molecular Structure:
Molecular Structure of 25646-71-3 (2-[(4-Amino-3-methylphenyl)ethylamino]ethyl sulfate)
Formula: 2(C12H21N3O2S).3(H2SO4)
Molecular Weight: 837.006
Synonyms: Color Developer-3;CD-3;N-[2-(4-Amino-N-ethyl-m-toluidino)ethyl]methanesulfonamide sulfate;Methanesulfonamide,N-[2-[(4-amino-3- methylphenyl)ethylamino]ethyl]-,sulfate (2:3);N4-Ethyl-N4(2-methansulfonamidoethyl)-2-methyl-1,4-phenylendiamine(sesquisulfate,Monohydrate) (CD 3);CD-III;CD 3;Methanesulfonamide, N-[2- (4-amino-N-ethyl-m-toluidino)ethyl]-, sulfate (2:3);Methanesulfonamide, N-[2-[ (4-amino-3-methylphenyl)ethylamino]ethyl]-, sulfate (2:3);FCD 03;Kodak CD-3;
EINECS: 247-161-5
Density: 1.204g/cm3
Melting Point: 168 - 169ºC
Boiling Point: 455 °C at 760 mmHg
Flash Point: 229 °C
Solubility: 1000g/L at 20℃
Appearance: Solid.
Hazard Symbols: T,N,Xn
Risk Codes: 25-36/37/38-43-50/53-22-34-23/24/25
Safety: 26-36/37-45-61-60-37-24-36/37/39-27
PSA: 83.81000
LogP: 3.00560
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  • 2-[(4-Amino-3-methylphenyl)ethylamino]ethyl sulfate

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    2-[(4-Amino-3-methylphenyl)ethylamino]ethyl sulfate

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Chemistry

IUPAC Name: N-[2-(4-amino-N-ethyl-3-methylanilino)ethyl]methanesulfonamide; sulfuric acid 
Canonical SMILES: CCN(CCNS(=O)(=O)C)C1=CC(=C(C=C1)N)C.CCN(CCNS(=O)(=O)C)C1=CC(=C(C=C1)N)C.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O
InChI: InChI=1S/2C12H21N3O2S.3H2O4S/c2*1-4-15(8-7-14-18(3,16)17)11-5-6-12(13)10(2)9-11;3*1-5(2,3)4/h2*5-6,9,14H,4,7-8,13H2,1-3H3;3*(H2,1,2,3,4)
EINECS: 247-161-5
Molecular Formula: C11H18N2O4S
Molecular Weight: 274.34 g/mol
Following is the structure of Methanesulfonamide, N-(2-((4-amino-3-methylphenyl)ethylamino)ethyl)-, sulfate (2:3) (9CI) (CAS NO.25646-71-3):


Product Categories: Industria l/ Fine Chemicals
Classification Code: Drug / Therapeutic Agent
Flash Point: 229 °C
Enthalpy of Vaporization: 71.47 kJ/mol
Boiling Point: 455 °C at 760 mmHg
Vapour Pressure: 1.82E-08 mmHg at 25 °C

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 unreported 385mg/kg (385mg/kg) BEHAVIORAL: EXCITEMENT

BEHAVIORAL: ATAXIA

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(9), Pg. 71, 1986.
mouse LD50 unreported 220mg/kg (220mg/kg) BEHAVIORAL: EXCITEMENT

BEHAVIORAL: ATAXIA

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(9), Pg. 71, 1986.
rat LD50 oral 152mg/kg (152mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA

BLOOD: HEMORRHAGE
National Technical Information Service. Vol. OTS0570977,
rat LD50 unreported 457mg/kg (457mg/kg) BEHAVIORAL: EXCITEMENT

BEHAVIORAL: ATAXIA

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(9), Pg. 71, 1986.

Safety Profile

A poison by ingestion. When heated to decomposition it emits toxic vapors of NOx and SOx.
Hazard Codes:ToxicT,DangerousN,HarmfulXn
Risk Statements:
R22 Harmful if swallowed.
R25 Toxic if swallowed.
R34 Causes burns.
R43 May cause sensitization by skin contact.
R23/24/25: Toxic by inhalation, in contact with skin and if swallowed. 
R36/37/38: Irritating to eyes, respiratory system and skin.
R50/53: Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
Safety Statements:
S24 Avoid contact with skin. 
S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S27 Take off immediately all contaminated clothing.
S37 Wear suitable gloves.
S45 In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
S60 This material and its container must be disposed of as hazardous waste. 
S61 Avoid release to the environment. Refer to special instructions / safety data sheets.
S36/37: Wear suitable protective clothing and gloves. 
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
Attention:
1. Storage: Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
2. Handling: Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation. Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation.

Specification

 The chemical synonymous of Methanesulfonamide, N-(2-((4-amino-3-methylphenyl)ethylamino)ethyl)-, sulfate (2:3) (9CI) (CAS NO.25646-71-3) are CD-3 ; 4-(N-Ethyl-N-2-methanesulfonylaminoethyl)-2-Methylphenylenediamine sesquisulfate hydrate ; N4-Ethyl-N4-(2-methanesulfonamidoethyl)-2-methyl-1,4-phenylenediamine sesquisulfate monohydrate ; N-[2-[(4-Amino-3-methylphenyl)ethylamino]ethyl]methanesulfonamide sesquisulfate monohydrate .