(4-ethoxycarbonylphenyl) 4-(diaminomethylideneamino)benzoate

CAS: 52134-52-8

Molecular Formula	`C17H17N3O4`
Molecular Weight	327.33 g/mol
LogP	2.0
Topological Polar Surface Area	117.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	7
Exact Mass	327.12192
Heavy Atoms	24
Complexity	460.0

Chemical Identifiers

CAS Number	52134-52-8
SMILES	`CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N`
InChIKey	`QQEFLVAOLVLVTK-UHFFFAOYSA-N`

📖 Product Overview

(4-ethoxycarbonylphenyl) 4-(diaminomethylideneamino)benzoate (CAS: 52134-52-8) is a chemical compound with molecular formula C17H17N3O4 and molecular weight 327.33 g/mol. Its IUPAC systematic name is (4-ethoxycarbonylphenyl) 4-(diaminomethylideneamino)benzoate. LogP 2.0 Topological Polar Surface Area 117.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 7 Exact Mass 327.12192 Heavy Atoms 24 Complexity 460.0 InChI Key: QQEFLVAOLVLVTK-UHFFFAOYSA-N. SMILES: CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N.

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