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[2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 3,5-bis(trifluoromethyl)benzoate

[2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 3,5-bis(trifluoromethyl)benzoate structure

CAS No:
479698-03-8
Formula:
C17H9F7N2O5
Chemical Name:
[2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 3,5-bis(trifluoromethyl)benzoate
Synonyms:
ZINC3300391;AKOS033631921;MCULE-8246109349;AB00717504-01;Z18565986;[(4-fluoro-3-nitrophenyl)carbamoyl]methyl 3,5-bis(trifluoromethyl)benzoate;479698-03-8

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[2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 3,5-bis(trifluoromethyl)benzoate Basic Attributes

Molecular Weight：

454.25 g/mol

Exact Mass：

454.03996853 g/mol

Characteristics

PSA：

101 Å²

Computed Properties

Molecular Weight:454.25
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:5
Exact Mass:454.03996853
Monoisotopic Mass:454.03996853
Topological Polar Surface Area:101
Heavy Atom Count:31
Complexity:657
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 3,5-bis(trifluoromethyl)benzoate

Basic Attributes
Characteristics
Computed Properties
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