(1-methoxy-2-phenyl-2-propoxyethyl)benzene

C18H22O2 — CID 175600461

IUPAC(1-methoxy-2-phenyl-2-propoxyethyl)benzene
SMILESCCCOC(c1ccccc1)C(OC)c1ccccc1
InChIInChI=1S/C18H22O2/c1-3-14-20-18(16-12-8-5-9-13-16)17(19-2)15-10-6-4-7-11-15/h4-13,17-18H,3,14H2,1-2H3
InChIKeyKECOQAKWXWLNSR-UHFFFAOYSA-N
MW270.37 g/mol
LogP4.54
Rot. Bonds7

About (1-methoxy-2-phenyl-2-propoxyethyl)benzene

(1-methoxy-2-phenyl-2-propoxyethyl)benzene (PubChem CID 175600461) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is (1-methoxy-2-phenyl-2-propoxyethyl)benzene.

Molecular Properties

Compound Name(1-methoxy-2-phenyl-2-propoxyethyl)benzene
PubChem CID175600461
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Name(1-methoxy-2-phenyl-2-propoxyethyl)benzene
SMILESCCCOC(c1ccccc1)C(OC)c1ccccc1
InChIInChI=1S/C18H22O2/c1-3-14-20-18(16-12-8-5-9-13-16)17(19-2)15-10-6-4-7-11-15/h4-13,17-18H,3,14H2,1-2H3
InChIKeyKECOQAKWXWLNSR-UHFFFAOYSA-N
XLogP4.54
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[(1R,2R)-2-phenyl-1,2-dipropoxyethyl]benzene
CID 10983775
[(1S,2S)-1-ethoxy-2-methoxy-2-phenylethyl]benzene
CID 143834566
(1,2-dihexoxy-2-phenylethyl)benzene
CID 14092843
1-methoxy-1-phenyl-3-propoxypropan-2-amine
CID 116773005
(1-phenyl-1-propoxypropan-2-yl) propanoate
CID 155148718
[1-butoxy-2-(3-methylbutoxy)-2-phenylethyl]benzene
CID 139393088
[1,2-bis(2-bromoethoxy)-2-phenylethyl]benzene
CID 10717396
1-methoxy-1-phenylbutan-2-ol
CID 116756893
1-methoxy-1-phenyl-N-propylpropan-2-amine
CID 116773234
(2S,3R)-3-methoxy-3-phenylpropane-1,2-diol
CID 14249015
1-methoxy-4-[(1S,2S)-2-[2-[(1S,2S)-2-[2-[(1S,2S)-2-(4-methoxyphenyl)-1,2-diphenylethoxy]ethoxy]-1,2-diphenylethoxy]ethoxy]-1,2-diphenylethyl]benzene
CID 101271686
1-methyl-4-[phenyl(propoxy)methyl]benzene
CID 54382280

Frequently Asked Questions

What is the IUPAC name of (1-methoxy-2-phenyl-2-propoxyethyl)benzene?
The IUPAC name of (1-methoxy-2-phenyl-2-propoxyethyl)benzene (CID 175600461) is (1-methoxy-2-phenyl-2-propoxyethyl)benzene.
What is the SMILES notation for (1-methoxy-2-phenyl-2-propoxyethyl)benzene?
The canonical SMILES for (1-methoxy-2-phenyl-2-propoxyethyl)benzene is CCCOC(c1ccccc1)C(OC)c1ccccc1.
What is the InChIKey of (1-methoxy-2-phenyl-2-propoxyethyl)benzene?
The InChIKey is KECOQAKWXWLNSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2/c1-3-14-20-18(16-12-8-5-9-13-16)17(19-2)15-10-6-4-7-11-15/h4-13,17-18H,3,14H2,1-2H3.
What are the key properties of (1-methoxy-2-phenyl-2-propoxyethyl)benzene?
(1-methoxy-2-phenyl-2-propoxyethyl)benzene has a molecular weight of 270.37 g/mol, XLogP of 4.54, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxy-2-phenyl-2-propoxyethyl)benzene is sourced from PubChem (CID 175600461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).