2-Hydroxyethyl cycloheptyl sulfide

HCID 22454073
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Basic information

Standard SMILES
OCCSC1CCCCCC1
InChIKey
ZXUZIZVLWRZPBC-UHFFFAOYSA-N
Molecular formula
C9H18OS
Average molar mass
174.31 g/mol
Monoisotopic mass
174.10783637

Names & identifiers

Preferred name
2-Hydroxyethyl cycloheptyl sulfide
IUPAC
2-cycloheptylsulfanylethanol

Names & synonyms

SCHEMBL66037102-hydroxyethyl cycloheptyl sulfideZXUZIZVLWRZPBC-UHFFFAOYSA-NAKOS021247433

Database identifiers

PubChem CID
22454073

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
45.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
11

Related reactions

4 records
New reaction record

Compound notes

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