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3-heptyl-2,5-dihydroxycyclohexa-2,5-diene-1,4-dione

3-heptyl-2,5-dihydroxycyclohexa-2,5-diene-1,4-dione structure

CAS No:
650571-85-0
Formula:
C13H18O4
Chemical Name:
3-heptyl-2,5-dihydroxycyclohexa-2,5-diene-1,4-dione
Synonyms:
3-Heptyl-2,5-dihydroxy-[1,4]benzoquinone;3-heptyl-2,5-dihydroxycyclohexa-2,5-diene-1,4-dione;650571-85-0;CHEMBL2296056;ZINC2048978;3-heptyl-2,5-dihydroxy-1,4-benzoquinone;2,5-dihydroxy-3-heptyl-2,5-cyclohexadiene-1,4-dione

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3-heptyl-2,5-dihydroxycyclohexa-2,5-diene-1,4-dione Basic Attributes

Molecular Weight：

238.28 g/mol

Exact Mass：

238.12050905 g/mol

Characteristics

PSA：

74.6 Å²

Computed Properties

Molecular Weight:238.28
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:238.12050905
Monoisotopic Mass:238.12050905
Topological Polar Surface Area:74.6
Heavy Atom Count:17
Complexity:377
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-heptyl-2,5-dihydroxycyclohexa-2,5-diene-1,4-dione

Basic Attributes
Characteristics
Computed Properties

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