ethane;1-methyl-2-phenoxybenzene

C15H18O — CID 90950955

IUPACethane;1-methyl-2-phenoxybenzene
SMILESCC.Cc1ccccc1Oc1ccccc1
InChIInChI=1S/C13H12O.C2H6/c1-11-7-5-6-10-13(11)14-12-8-3-2-4-9-12;1-2/h2-10H,1H3;1-2H3
InChIKeyOZZLGTLXKQYUEJ-UHFFFAOYSA-N
MW214.31 g/mol
LogP4.81
Rot. Bonds2

About ethane;1-methyl-2-phenoxybenzene

ethane;1-methyl-2-phenoxybenzene (PubChem CID 90950955) has the molecular formula C15H18O and a molecular weight of 214.31 g/mol. Its IUPAC name is ethane;1-methyl-2-phenoxybenzene.

Molecular Properties

Compound Nameethane;1-methyl-2-phenoxybenzene
PubChem CID90950955
Molecular FormulaC15H18O
Molecular Weight214.31 g/mol
Exact Mass214.14
IUPAC Nameethane;1-methyl-2-phenoxybenzene
SMILESCC.Cc1ccccc1Oc1ccccc1
InChIInChI=1S/C13H12O.C2H6/c1-11-7-5-6-10-13(11)14-12-8-3-2-4-9-12;1-2/h2-10H,1H3;1-2H3
InChIKeyOZZLGTLXKQYUEJ-UHFFFAOYSA-N
XLogP4.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-methyl-2-(3-phenoxyphenoxy)benzene
CID 91183986
ethane;1-methyl-2-(2-methylphenoxy)benzene
CID 90755051
1-methyl-2-[4-[[4-(2-methylphenoxy)phenyl]methoxymethyl]phenoxy]benzene
CID 67084607
N,N,2-trimethyl-6-phenoxyaniline
CID 91549486
ethane;1-methoxy-3-methyl-2-phenoxybenzene
CID 155714526
ethane;1-fluoro-2-phenoxybenzene
CID 170962676
4-(2-methylphenoxy)benzenecarbothioamide
CID 20985850
1,3-dimethyl-2-(2-phenoxyphenyl)sulfanylbenzene
CID 175940510
4-(2-methylphenoxy)benzoate
CID 7010211
1-[4-(2-methylphenoxy)phenyl]pyrrolidine
CID 168515858
1-(chloromethyl)-3-(2-methylphenoxy)benzene
CID 112594476
1,2,3-tris(2-methylphenoxy)benzene
CID 139940567

Frequently Asked Questions

What is the IUPAC name of ethane;1-methyl-2-phenoxybenzene?
The IUPAC name of ethane;1-methyl-2-phenoxybenzene (CID 90950955) is ethane;1-methyl-2-phenoxybenzene.
What is the SMILES notation for ethane;1-methyl-2-phenoxybenzene?
The canonical SMILES for ethane;1-methyl-2-phenoxybenzene is CC.Cc1ccccc1Oc1ccccc1.
What is the InChIKey of ethane;1-methyl-2-phenoxybenzene?
The InChIKey is OZZLGTLXKQYUEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12O.C2H6/c1-11-7-5-6-10-13(11)14-12-8-3-2-4-9-12;1-2/h2-10H,1H3;1-2H3.
What are the key properties of ethane;1-methyl-2-phenoxybenzene?
ethane;1-methyl-2-phenoxybenzene has a molecular weight of 214.31 g/mol, XLogP of 4.81, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methyl-2-phenoxybenzene is sourced from PubChem (CID 90950955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).