Dimethyl 2,5-dianilinocyclohexa-1,4-diene-1,4-dicarboxylate

dimethyl 2,5-dianilinocyclohexa-1,4-diene-1,4-dicarboxylate

CAS: 4898-58-2

Molecular Formula	`C22H22N2O4`
Molecular Weight	378.4 g/mol
LogP	4.9
Topological Polar Surface Area	76.7 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	8
Exact Mass	378.15796
Heavy Atoms	28
Complexity	585.0

Chemical Identifiers

CAS Number	4898-58-2
SMILES	`COC(=O)C1=C(CC(=C(C1)NC2=CC=CC=C2)C(=O)OC)NC3=CC=CC=C3`
InChIKey	`JAWHCRQIVXIBNR-UHFFFAOYSA-N`

📖 Product Overview

Dimethyl 2,5-dianilinocyclohexa-1,4-diene-1,4-dicarboxylate (CAS: 4898-58-2) is a chemical compound with molecular formula C22H22N2O4 and molecular weight 378.4 g/mol. Its IUPAC systematic name is dimethyl 2,5-dianilinocyclohexa-1,4-diene-1,4-dicarboxylate. LogP 4.9 Topological Polar Surface Area 76.7 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 8 Exact Mass 378.15796 Heavy Atoms 28 Complexity 585.0 InChI Key: JAWHCRQIVXIBNR-UHFFFAOYSA-N. SMILES: COC(=O)C1=C(CC(=C(C1)NC2=CC=CC=C2)C(=O)OC)NC3=CC=CC=C3.

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