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2-(N-[2-(4-ethoxyphenoxy)acetyl]-3-methoxyanilino)ethyl-diethylazanium,2,4,6-trinitrophenolate

2-(N-[2-(4-ethoxyphenoxy)acetyl]-3-methoxyanilino)ethyl-diethylazanium,2,4,6-trinitrophenolate structure

CAS No:
27471-65-4
Formula:
C29H35N5O11
Chemical Name:
2-(N-[2-(4-ethoxyphenoxy)acetyl]-3-methoxyanilino)ethyl-diethylazanium,2,4,6-trinitrophenolate
Synonyms:
m-ACETANISIDIDE,N-(2-(DIETHYLAMINO)ETHYL)-2-(p-ETHOXYPHENOXY)-,MONOPICRATE; 2-{[(4-ethoxyphenoxy)acetyl](3-methoxyphenyl)amino}-N,N-diethylethanaminium 2,4,6-trinitrophenolate; N-(2-(Diethylamino)ethyl)-2-(p-ethoxyphenoxy)-m-acetanisidide picrate;

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2-(N-[2-(4-ethoxyphenoxy)acetyl]-3-methoxyanilino)ethyl-diethylazanium,2,4,6-trinitrophenolate Basic Attributes

Molecular Weight：

629.61500

Exact Mass：

629.23330695 g/mol

DSSTox ID：

DTXSID90181897

Characteristics

PSA：

208.93000

XLogP3：

6.53410

Boiling Point：

537.7ºC at 760 mmHg

Flash Point：

279ºC

Vapor Pressure：

1.24E-11mmHg at 25°C

Computed Properties

Molecular Weight:629.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:12
Exact Mass:629.23330695
Monoisotopic Mass:629.23330695
Topological Polar Surface Area:213
Heavy Atom Count:45
Complexity:742
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 2-(N-[2-(4-ethoxyphenoxy)acetyl]-3-methoxyanilino)ethyl-diethylazanium,2,4,6-trinitrophenolate

Basic Attributes
Characteristics
Computed Properties

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