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N',N'-diethyl-N-(7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium-4-yl)propane-1,3-diamine

N',N'-diethyl-N-(7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium-4-yl)propane-1,3-diamine structure

CAS No:
78329-76-7
Formula:
C13H19N5O4
Chemical Name:
N',N'-diethyl-N-(7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium-4-yl)propane-1,3-diamine
Synonyms:
BENZOFURAZAN, 7-(3-(DIETHYLAMINO)PROPYLAMINO)-4-NITRO-, 1-OXIDE;78329-76-7;NSC 288662;NSC288662;7-(3-(Diethylamino)propylamino)-4-nitrobenzofurazan 1-oxide;DTXSID40228983;ZINC5432054;NSC-288662;1, N,N-diethyl-N'-(7-nitro-4-benzofurazanyl)-, N-oxide;1,3-Propanediamine, N,N-diethyl-N'-(7-nitro-4-benzofurazanyl)-, N-oxide (9CI)

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N',N'-diethyl-N-(7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium-4-yl)propane-1,3-diamine Basic Attributes

Molecular Weight：

309.32 g/mol

Exact Mass：

309.14370410 g/mol

NSC Number：

288662

DSSTox ID：

DTXSID40228983

Characteristics

PSA：

113 Å²

Computed Properties

Molecular Weight:309.32
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:309.14370410
Monoisotopic Mass:309.14370410
Topological Polar Surface Area:113
Heavy Atom Count:22
Complexity:363
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N',N'-diethyl-N-(7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium-4-yl)propane-1,3-diamine

Basic Attributes
Characteristics
Computed Properties

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