methylsulfanyloxyethene

C3H6OS — CID 57280562

IUPACmethylsulfanyloxyethene
SMILESC=COSC
InChIInChI=1S/C3H6OS/c1-3-4-5-2/h3H,1H2,2H3
InChIKeyBWSQFBVJJOEGJU-UHFFFAOYSA-N
MW90.15 g/mol
LogP1.42
Rot. Bonds2

About methylsulfanyloxyethene

methylsulfanyloxyethene (PubChem CID 57280562) has the molecular formula C3H6OS and a molecular weight of 90.15 g/mol. Its IUPAC name is methylsulfanyloxyethene.

Molecular Properties

Compound Namemethylsulfanyloxyethene
PubChem CID57280562
Molecular FormulaC3H6OS
Molecular Weight90.15 g/mol
Exact Mass90.01
IUPAC Namemethylsulfanyloxyethene
SMILESC=COSC
InChIInChI=1S/C3H6OS/c1-3-4-5-2/h3H,1H2,2H3
InChIKeyBWSQFBVJJOEGJU-UHFFFAOYSA-N
XLogP1.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50090.15
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'sulfur_oxygen_single_bond', 'substructure': 'N/A'}

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Related Compounds

methoxyethene;molecular hydrogen
CID 173062659
ethenoxyethene;prop-1-ene
CID 22912569
ethenoxyethene;ethenyl(trimethoxy)silane
CID 174894710
3-methoxy-3-methylsulfanylprop-1-ene
CID 18720097
CID 102374318
CID 102374318
ethenoxystannane
CID 149435720
CID 159014150
CID 159014150
CID 58444512
CID 58444512
ethenoxysilane
CID 71403767
N-methylsulfanylethenamine
CID 166090975
prop-2-enylsulfanyl formate
CID 87571531
prop-1-ene
CID 162178440

Frequently Asked Questions

What is the IUPAC name of methylsulfanyloxyethene?
The IUPAC name of methylsulfanyloxyethene (CID 57280562) is methylsulfanyloxyethene.
What is the SMILES notation for methylsulfanyloxyethene?
The canonical SMILES for methylsulfanyloxyethene is C=COSC.
What is the InChIKey of methylsulfanyloxyethene?
The InChIKey is BWSQFBVJJOEGJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6OS/c1-3-4-5-2/h3H,1H2,2H3.
What are the key properties of methylsulfanyloxyethene?
methylsulfanyloxyethene has a molecular weight of 90.15 g/mol, XLogP of 1.42, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methylsulfanyloxyethene is sourced from PubChem (CID 57280562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).