Carbamodithioic acid, diethyl-, 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl ester

Carbamodithioic acid, diethyl-, 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6 -dioxo-7H-purin-7-yl)ethyl ester · Carbamodithioic acid, diethyl-, 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl ester (9CI)

https://huagongshe.com/de/chemical/3075413

Molekülstruktur von Carbamodithioic acid, diethyl-, 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl ester

Identifikatoren & physikalische Daten

CAS No.	180301-43-3
Summenformel	C14H21N5O2S2
Durchschnittliche Molmasse	355,489 g/mol
Monoisotopische Masse	355,11366691 g/mol
SMILES	CCN(CC)C(=S)SCCn1cnc2c1c(=O)n(C)c(=O)n2C
InChIKey	WDIRJZXAQSLJGW-UHFFFAOYSA-N
PubChem CID	3075413
DTXSID	DTXSID50170949

Chemische & physikalische Eigenschaften

Siedepunkt	549.8±60.0 °C(Predicted)
Dichte	1.35±0.1 g/cm3(Predicted)
pKa (Säurekonstante)	0.91±0.50(Predicted)