NSC407182 structure

NSC407182

(2R,6S)-2,4,4,6,8,8-hexachloro-2-N,6-N-bis(4-methylphenyl)-1,3,5,7-tetraza-2λ5,4λ5,6λ5,8λ5-tetraphosphacycloocta-1,3,5,7-tetraene-2,6-diamine

Also Known As: 2,4,4,6,8,8-hexachloro-2-N,6-N-bis(4-methylphenyl)-1,3,5,7-t|2,4,4,6,8,8-hexachloro-2-N,6-N-bis(4-methylphenyl)-1,3,5,7-tetraza-2|2,4,4,6,8,8-hexachloro-2-N,6-N-bis(4-methylphenyl)-1,3,5,7-tetraza-2lambda5,4lambda5,6lambda5,8lambda5-tetraphosphacycloocta-1,3,5,7-tetraene-2,6-diamine|2,4,4,6,8,8-Hexachloro-N~2~,N~6~-bis(4-methylphenyl)-1,3,5,7,2lambda~5~,4lambda~5~,6lambda~5~,8lambda~5~-tetrazatetraphosphocine-2,6-diamine

CAS: 7702-45-6
Molecular Formula C14H16Cl6N6P4
Molecular Weight 601.8518 g/mol
LogP 10.0
Topological Polar Surface Area 73.5 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 4
Exact Mass 601.8518
Monoisotopic Mass 601.8518
Heavy Atoms 30
Complexity 742.0

Chemical Identifiers

CAS Number 7702-45-6
SMILES CC1=CC=C(C=C1)N[P@]2(=NP(=N[P@@](=NP(=N2)(Cl)Cl)(NC3=CC=C(C=C3)C)Cl)(Cl)Cl)Cl
InChIKey FZWAOQUWWADMCN-WXUXXXNLSA-N

Product Overview

NSC407182 (CAS 7702-45-6), with molecular formula C14H16Cl6N6P4 and molecular weight 601.8518 g/mol. IUPAC: (2R,6S)-2,4,4,6,8,8-hexachloro-2-N,6-N-bis(4-methylphenyl)-1,3,5,7-tetraza-2λ5,4λ5,6λ5,8λ5-tetraphosphacycloocta-1,3,5,7-tetraene-2,6-diamine.

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