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2- (ethylthio) benzofuran

CAT: 0127-OR1085443Size: 1 EachDry Ice: NoHazardous: No
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CAS Number
172366-93-7
Smiles
C1ccc2c (c1) cc (o2) SCC

Chemical Information

Benzofuran, 2-(ethylthio)-
CAS Number172366-93-7
PubChem CID10797421
IUPAC Name2-ethylsulfanyl-1-benzofuran
Molecular FormulaC10H10OS
Molecular Weight178.25
XLogP3.8
Topological Polar Surface Area38.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity149
SMILES
CCSC1=CC2=CC=CC=C2O1
InChI
InChI=1S/C10H10OS/c1-2-12-10-7-8-5-3-4-6-9(8)11-10/h3-7H,2H2,1H3
InChIKey
HOJVIYBXEORQHM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzofuran, 2-(ethylthio)-
CAS: 172366-93-7
CID: 10797421
Formula: C10H10OS
MW: 178.25
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight178.25
XLogP33.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass178.04523611
Monoisotopic Mass178.04523611
Topological Polar Surface Area38.4 Ų
Heavy Atom Count12
Formal Charge0
Complexity149
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
011821(Ethylthio) trimethylsilane
MBS6026407-01(Ethylthio)trimethylsilane
sc-269193(Ethylthio) acetone
442344-01Benzofuran
JH916582((ethylthio) methoxy) triisopropylsilane
abx186289-014-(Ethylthio)toluene
sc-280170Tris (ethylthio) methane
sc-2671524- (Ethylthio) benzaldehyde
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sc-2802612- (Ethylthio) ethylamine

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