Diethyl[2-(4-nitrophenoxy)ethyl]amine

HCID 88294

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Basic information

CAS: 19881-36-8
Standard SMILES: CCN(CC)CCOc1ccc([N+](=O)[O-])cc1
InChIKey: ZLZZAXUKBHFTHA-UHFFFAOYSA-N
Molecular formula: C12H18N2O3
Average molar mass: 238.28 g/mol
Monoisotopic mass: 238.13174244

Names & identifiers

Preferred name: Diethyl[2-(4-nitrophenoxy)ethyl]amine
IUPAC: N,N-diethyl-2-(4-nitrophenoxy)ethanamine
English name: N,N-Diethyl-2-(4-nitrophenoxy)ethanaMine
Molecular formula: C12H18N2O3
Molecular weight: 238.28

Names & synonyms

N,N-diethyl-2-(4-nitrophenoxy)ethanamine19881-36-8Diethyl[2-(4-nitrophenoxy)ethyl]amineMFCD01308350Diethyl(2-(4-nitrophenoxy)ethyl)amineEthanamine, N,N-diethyl-2-(4-nitrophenoxy)-N,N-Diethyl-2-(4-nitrophenoxy)ethan-1-aminediethyl-[2-(4-nitro-phenoxy)-ethyl]-amineCBMicro_0202992-(p-Nitrophenoxy)triethylamineN,N-Diethyl-2-(4-nitrophenoxy)ethanamine; 2-(p-Nitrophenoxy)triethylamine;VOB

Show more names

EINECS 243-394-1Cambridge id 546651166NZ9CXC7ZOprea1_181916SCHEMBL1735260DTXSID10173638CCG-8278AKOS015838648

Database identifiers

CAS: 19881-36-8
PubChem CID: 88294
DTXSID: DTXSID10173638
UNII: 66NZ9CXC7Z
EC Number: 243-394-1
Nikkaji: J280.389E

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 58.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 6
Heavy atoms: 17
Formal charge: 0
Complexity: 218

Physicochemical properties

storage temp.: 2 · 2-8°C
solubility: Chloroform, Dichloromethane, DMSO, Ethyl Acetate, Methanol
form: Oil
color: Brown
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H315-H319-H335
Precautionary statements: P261-P305+P351+P338

Chemistry & industry

Applications

UsesN,N-Diethyl-2-(4-nitrophenoxy)ethanaMine can be used as an intermediate used in the production of local anesthetics, PK inhibitors, and other biologically active molecules.