2-[(Ethylsulfanyl)methyl]phenol

HCID 522167CAS 65370-06-1
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Basic information

Standard SMILES
CCSCc1ccccc1O
InChIKey
QZBBPVLBIUUYRH-UHFFFAOYSA-N
Molecular formula
C9H12OS
Average molar mass
168.26 g/mol
Monoisotopic mass
168.06088618

Names & identifiers

Preferred name
2-[(Ethylsulfanyl)methyl]phenol
IUPAC
2-(ethylsulfanylmethyl)phenol
English name
alpha-(ethylthio)-o-cresol
Molecular formula
C9H12OS
Molecular weight
168.26

Names & synonyms

2-[(Ethylsulfanyl)methyl]phenol65370-06-1alpha-(Ethylthio)-o-cresol2-(ethylsulfanylmethyl)phenolEthyl 2-hydroxybenzyl sulfide2-[(ethylthio)methyl]phenolPhenol, 2-[(ethylthio)methyl]-2-((Ethylthio)methyl)phenol2-ETHYLTHIOMETHYLPHENOLEINECS 265-720-1starbld00310602-ethylthiomethyl-phenol
Show more names
α-(ethylthio)-o-cresol2-Ethylthiomethyl phenol Solution2-Ethylthiomethyl phenol Solution in Methanol
SCHEMBL9511130CHEBI:38487DTXSID409839842-[(Ethylsulfanyl)methyl]phenol #AKOS006277902NS00056179Q27117876

Database identifiers

CAS
65370-06-1
PubChem CID
522167
DTXSID
DTXSID40983984
ChEBI
CHEBI:38487
EC Number
265-720-1
Nikkaji
J307.383A

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
45.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
11

Experimental & physicochemical properties

Kovats Retention Index1404

Chemistry & industry

Suppliers2 total

青州达丰进出口有限公司16773308882 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Additional notes

DefinitionChEBI: 2-[(ethylsulfanyl)methyl]phenol is an organic sulfide and a member of phenols. It is functionally related to an o-cresol.

Related reactions

9 records
New reaction record

Linked notes

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