methoxymethane;phenylsulfanylbenzene

C14H16OS — CID 175087336

IUPACmethoxymethane;phenylsulfanylbenzene
SMILESCOC.c1ccc(Sc2ccccc2)cc1
InChIInChI=1S/C12H10S.C2H6O/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-2/h1-10H;1-2H3
InChIKeyVKRVJWVSVYMZLZ-UHFFFAOYSA-N
MW232.35 g/mol
LogP4.10
Rot. Bonds2

About methoxymethane;phenylsulfanylbenzene

methoxymethane;phenylsulfanylbenzene (PubChem CID 175087336) has the molecular formula C14H16OS and a molecular weight of 232.35 g/mol. Its IUPAC name is methoxymethane;phenylsulfanylbenzene.

Molecular Properties

Compound Namemethoxymethane;phenylsulfanylbenzene
PubChem CID175087336
Molecular FormulaC14H16OS
Molecular Weight232.35 g/mol
Exact Mass232.09
IUPAC Namemethoxymethane;phenylsulfanylbenzene
SMILESCOC.c1ccc(Sc2ccccc2)cc1
InChIInChI=1S/C12H10S.C2H6O/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-2/h1-10H;1-2H3
InChIKeyVKRVJWVSVYMZLZ-UHFFFAOYSA-N
XLogP4.10
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

CID 66690055
CID 66690055
1,4-bis(phenylsulfanyl)benzene;ethane;tritiomethane
CID 158378208
1,3-dimethoxy-5-phenylsulfanylbenzene
CID 122365183
acetonitrile;phenylsulfanylbenzene
CID 175483964
ethanethiol;phenylsulfanylbenzene
CID 174826904
1-(methoxymethyl)-4-phenylsulfanylbenzene
CID 174608576
dichlororuthenium;phenylsulfanylbenzene
CID 18541858
1,3-bis[(3-phenylsulfanylphenyl)sulfanyl]benzene
CID 21413042
methyl 2-methylprop-2-enoate;phenylsulfanylbenzene
CID 174614138
methyl 2-oxo-2-(4-phenylsulfanylphenyl)acetate
CID 59163554
4-[4-[4-[4-(4-phenylsulfanylphenyl)sulfanylphenyl]sulfanylphenyl]sulfanylphenyl]sulfanylbenzenethiol
CID 102317381
phenylsulfanylbenzene;urea
CID 161199097

Frequently Asked Questions

What is the IUPAC name of methoxymethane;phenylsulfanylbenzene?
The IUPAC name of methoxymethane;phenylsulfanylbenzene (CID 175087336) is methoxymethane;phenylsulfanylbenzene.
What is the SMILES notation for methoxymethane;phenylsulfanylbenzene?
The canonical SMILES for methoxymethane;phenylsulfanylbenzene is COC.c1ccc(Sc2ccccc2)cc1.
What is the InChIKey of methoxymethane;phenylsulfanylbenzene?
The InChIKey is VKRVJWVSVYMZLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10S.C2H6O/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-2/h1-10H;1-2H3.
What are the key properties of methoxymethane;phenylsulfanylbenzene?
methoxymethane;phenylsulfanylbenzene has a molecular weight of 232.35 g/mol, XLogP of 4.10, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethane;phenylsulfanylbenzene is sourced from PubChem (CID 175087336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).