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2,3-dimethoxy-5-octylsulfanylcyclohexa-2,5-diene-1,4-dione

2,3-dimethoxy-5-octylsulfanylcyclohexa-2,5-diene-1,4-dione structure

CAS No:
64101-97-9
Formula:
C16H24O4S
Chemical Name:
2,3-dimethoxy-5-octylsulfanylcyclohexa-2,5-diene-1,4-dione
Synonyms:
MLS003115189;64101-97-9;NSC237677;CHEMBL1736502;DTXSID70311094;ZINC1762477;NSC-237677;SMR001830772

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2,3-dimethoxy-5-octylsulfanylcyclohexa-2,5-diene-1,4-dione Basic Attributes

Molecular Weight：

312.4 g/mol

Exact Mass：

312.13953042 g/mol

NSC Number：

237677

DSSTox ID：

DTXSID70311094

Characteristics

PSA：

77.9 Å²

Computed Properties

Molecular Weight:312.4
XLogP3:4.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:10
Exact Mass:312.13953042
Monoisotopic Mass:312.13953042
Topological Polar Surface Area:77.9
Heavy Atom Count:21
Complexity:438
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,3-dimethoxy-5-octylsulfanylcyclohexa-2,5-diene-1,4-dione

Basic Attributes
Characteristics
Computed Properties

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