Ethyl phenyl sulfide

CAT: 0024-sc-239947Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-239947Size:5 g

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CAS Number

622-38-8

Chemical Information

(Ethylthio)benzene

CAS Number	622-38-8
PubChem CID	12144
IUPAC Name	ethylsulfanylbenzene
Molecular Formula	C8H10S
Molecular Weight	138.23
XLogP	3.2
Topological Polar Surface Area	25.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	9
Formal Charge	0
Complexity	65

SMILES

CCSC1=CC=CC=C1

InChI

InChI=1S/C8H10S/c1-2-9-8-6-4-3-5-7-8/h3-7H,2H2,1H3

InChIKey

AEHWKBXBXYNPCX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 622-38-8

CID: 12144

Formula: C8H10S

MW: 138.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	138.23
XLogP3	3.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	138.05032149
Monoisotopic Mass	138.05032149
Topological Polar Surface Area	25.3 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	65
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-252591	Chloromethyl phenyl sulfide
sc-236365A	Phenyl propargyl sulfide
sc-233899	Azidomethyl phenyl sulfide
sc-239632	Cyclopropyl phenyl sulfide
sc-236367	Phenyl trifluoromethyl sulfide
sc-228468	Methoxymethyl phenyl sulfide
sc-490108	Geranylgeranyl Phenyl Sulfide
sc-236368	Phenyl vinyl sulfide
sc-236365	Phenyl propargyl sulfide
sc-233995	Benzyl phenyl sulfide

Catalog	Name
449706-01	Ethyl Phenyl Sulfide
E14050-01	Ethyl phenyl sulfide 97%
OR956268	3-Nitro phenyl ethyl sulfide
OR1094812-01	Ethyl- (4-bromo-2-nitro-phenyl) -sulfide
591808	Phenyl sulfide
OR1078777-01	Ethyl Sulfide
260189-01	Allyl phenyl sulfide
164280	Geranylgeranyl Phenyl Sulfide
284900-01	Methoxymethyl Phenyl Sulfide
P15820-01	Phenyl sulfide 99%