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4-[(E)-3-hydroxyprop-1-enyl]-2-methoxycyclohexa-1,5-dien-1-ol

HCID 53302003
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Basic information

Standard SMILES
COC1=C(O)C=CC(/C=C/CO)C1
InChIKey
AALXOLVYFZPFPN-NSCUHMNNSA-N
Molecular formula
C10H14O3
Average molar mass
182.22 g/mol

Names & identifiers

Preferred name
4-[(E)-3-hydroxyprop-1-enyl]-2-methoxycyclohexa-1,5-dien-1-ol
IUPAC
4-[(E)-3-hydroxyprop-1-enyl]-2-methoxycyclohexa-1,5-dien-1-ol

Names & synonyms

AALXOLVYFZPFPN-NSCUHMNNSA-NAKOS015891161DB-030607

Database identifiers

PubChem CID
53302003

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
49.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
13
Formal charge
0
Complexity
251

Related reactions

1 records
New reaction record
HRID 48141 reaction equation
HRID 48141As productuspto-grants-2004_03

Compound notes

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