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81918-01-6

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81918-01-6 Structure

81918-01-6 Structure
IdentificationBack Directory
[Name]

Diethyl 2-[4-(chlorobenzoyl)amino]Malonate
[CAS]

81918-01-6
[Synonyms]

Diethyl 2-(4-chlorobenzaMido)Malonate
Diethyl 2-[4-(chlorobenzoyl)amino]Malonate
diethyl [(4-chlorobenzoyl)amino]propanedioate
diethyl 2-[(4-chlorobenzoyl)amino]propanedioate
diethyl (((4-chlorophenyl)carbonyl)amino)propanedioate
[(4-Chlorobenzoyl)-amino]-propanedioic acid diethyl ester
DIETHYL 4-CHLOROBENZAMIDOMALONATE[REBAMIPIDE INTERMEDIATE]
Propanedioic acid, 2-[(4-chlorobenzoyl)amino]-, 1,3-diethyl ester
[Molecular Formula]

C14H16ClNO5
[MDL Number]

MFCD09031363
[MOL File]

81918-01-6.mol
[Molecular Weight]

313.73
Questions And AnswerBack Directory
[Uses]

Diethyl 2-(4-chlorobenzamido)malonate is a reagent used in the synthesis of indole-based PPARγ ligands
Chemical PropertiesBack Directory
[Boiling point ]

458.6±45.0 °C(Predicted)
[density ]

1.264±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,2-8°C
[pka]

11.56±0.46(Predicted)
[InChI]

InChI=1S/C14H16ClNO5/c1-3-20-13(18)11(14(19)21-4-2)16-12(17)9-5-7-10(15)8-6-9/h5-8,11H,3-4H2,1-2H3,(H,16,17)
[InChIKey]

KTKBMOLVXVIHQA-UHFFFAOYSA-N
[SMILES]

C(OCC)(=O)C(NC(=O)C1=CC=C(Cl)C=C1)C(OCC)=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
[HS Code ]

2924297099
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