bis(diaminomethylidene-[4-(3,4,5-trimethoxybenzoyl)oxybutyl]azanium)sulfate

bis(diaminomethylidene-[4-(3,4,5-trimethoxybenzoyl)oxybutyl]azanium);sulfate

CAS: 75231-23-1

Molecular Formula	`C30H48N6O14S`
Molecular Weight	748.8 g/mol
Topological Polar Surface Area	329.0 A2
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	14
Rotatable Bonds	20
Exact Mass	748.2949
Heavy Atoms	51
Complexity	436.0

Chemical Identifiers

CAS Number	75231-23-1
SMILES	`COC1=CC(=CC(=C1OC)OC)C(=O)OCCCC[NH+]=C(N)N.COC1=CC(=CC(=C1OC)OC)C(=O)OCCCC[NH+]=C(N)N.[O-]S(=O)(=O)[O-]`
InChIKey	`JDLCXQSARZXHHD-UHFFFAOYSA-N`

📖 Product Overview

bis(diaminomethylidene-[4-(3,4,5-trimethoxybenzoyl)oxybutyl]azanium)sulfate (CAS: 75231-23-1) is a chemical compound with molecular formula C30H48N6O14S and molecular weight 748.8 g/mol. Its IUPAC systematic name is bis(diaminomethylidene-[4-(3,4,5-trimethoxybenzoyl)oxybutyl]azanium);sulfate. Topological Polar Surface Area 329.0 A2 Hydrogen Bond Donors 6 Hydrogen Bond Acceptors 14 Rotatable Bonds 20 Exact Mass 748.2949 Heavy Atoms 51 Complexity 436.0 InChI Key: JDLCXQSARZXHHD-UHFFFAOYSA-N. SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)OCCCC[NH+]=C(N)N.COC1=CC(=CC(=C1OC)OC)C(=O)OCCCC[NH+]=C(N)N.[O-]S(=O)(=O)[O-].

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