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2-(12-Hydroxy-5,10-dodecadiyn-1-yl)-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione

2-(12-Hydroxy-5,10-dodecadiyn-1-yl)-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione structure

CAS No:
80809-95-6
Formula:
C21H26O5
Chemical Name:
2-(12-Hydroxy-5,10-dodecadiyn-1-yl)-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione
Synonyms:
2,5-Cyclohexadiene-1,4-dione,2-(12-hydroxy-5,10-dodecadiyn-1-yl)-5,6-dimethoxy-3-methyl-;2,5-Cyclohexadiene-1,4-dione,2-(12-hydroxy-5,10-dodecadiynyl)-5,6-dimethoxy-3-methyl-;2-(12-Hydroxy-5,10-dodecadiyn-1-yl)-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione;AA 863

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2-(12-Hydroxy-5,10-dodecadiyn-1-yl)-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione Basic Attributes

Molecular Weight：

358.42814

Exact Mass：

358.43

DSSTox ID：

DTXSID00230643

Characteristics

PSA：

72.8

XLogP3：

3.5

Drug Information

MeSH Entry Terms：

AA 863

Computed Properties

Molecular Weight:358.4
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:358.17802393
Monoisotopic Mass:358.17802393
Topological Polar Surface Area:72.8
Heavy Atom Count:26
Complexity:727
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(12-Hydroxy-5,10-dodecadiyn-1-yl)-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione

Basic Attributes
Characteristics
Drug Information
Computed Properties

2-(12-Hydroxy-5,10-dodecadiyn-1-yl)-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione

SDS

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