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7-Diethylamino-3-[N-(2-maleimidoethyl)carbamoyl]coumarin

7-Diethylamino-3-[N-(2-maleimidoethyl)carbamoyl]coumarin structure

CAS No:
156571-46-9
Formula:
C20H21N3O5
Chemical Name:
7-Diethylamino-3-[N-(2-maleimidoethyl)carbamoyl]coumarin
Synonyms:
7-(diethylamino)-N-[2-(2,5-dioxopyrrol-1-yl)ethyl]-2-oxochromene-3-carboxamide;

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7-Diethylamino-3-[N-(2-maleimidoethyl)carbamoyl]coumarin Basic Attributes

Molecular Weight：

383.39800

Exact Mass：

383.14812078 g/mol

DSSTox ID：

DTXSID80166097

Characteristics

PSA：

99.93000

XLogP3：

1.62280

Density：

1.346g/cm3

Boiling Point：

695ºC

Flash Point：

371.4ºC

Refractive Index：

1.624

Vapor Pressure：

6.42E-19mmHg at 25°C

Safety Information

hazard class code：

R22

Marks：

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

MDCC fluorophore

Computed Properties

Molecular Weight:383.4
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:383.14812078
Monoisotopic Mass:383.14812078
Topological Polar Surface Area:96
Heavy Atom Count:28
Complexity:707
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-Diethylamino-3-[N-(2-maleimidoethyl)carbamoyl]coumarin

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

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