XAC HCL ,96865-92-8 _Chemical Cloud Database

XAC HCL

Basic Information
Product Name：	XAC HCL
CAS：	96865-92-8
English Synonyms：	XANTHINE AMINE CONGENER HCL ; XAC HCL
MDL Number.：	MFCD18086858
H bond acceptor：	10
H bond donor：	3
Smile：	CCCn1c2c(c(=O)n(c1=O)CCC)[nH]c(n2)c3ccc(cc3)OCC(=O)NCCN.Cl
InChi：	InChI=1S/C21H28N6O4.ClH/c1-3-11-26-19-17(20(29)27(12-4-2)21(26)30)24-18(25-19)14-5-7-15(8-6-14)31-13-16(28)23-10-9-22;/h5-8H,3-4,9-13,22H2,1-2H3,(H,23,28)(H,24,25);1H
InChiKey：	InChIKey=IVOSTHCDPHGPAS-UHFFFAOYSA-N

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