1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene

C17H18O — CID 170148355

IUPAC1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene
SMILESC=C(C)c1ccccc1-c1cccc(OC)c1C
InChIInChI=1S/C17H18O/c1-12(2)14-8-5-6-9-16(14)15-10-7-11-17(18-4)13(15)3/h5-11H,1H2,2-4H3
InChIKeyFVBMFKDKWVFTOS-UHFFFAOYSA-N
MW238.33 g/mol
LogP4.70
Rot. Bonds3

About 1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene

1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene (PubChem CID 170148355) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene.

Molecular Properties

Compound Name1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene
PubChem CID170148355
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene
SMILESC=C(C)c1ccccc1-c1cccc(OC)c1C
InChIInChI=1S/C17H18O/c1-12(2)14-8-5-6-9-16(14)15-10-7-11-17(18-4)13(15)3/h5-11H,1H2,2-4H3
InChIKeyFVBMFKDKWVFTOS-UHFFFAOYSA-N
XLogP4.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

bis(3-methoxy-2-methylphenyl)methanone
CID 139698462
formaldehyde;bis(1-(2-methoxyphenyl)ethanone)
CID 174959963
1-methoxy-2-[1-[1-(2-methoxyphenyl)ethenoxy]ethenyl]benzene
CID 69260601
3-methoxy-2-methylbenzenecarboperoxoic acid
CID 174349354
methyl 3-methoxy-2-methylbenzoate
CID 12527049
1,2-bis(prop-1-en-2-yl)benzene;hydrogen peroxide
CID 175029396
2-methoxy-N-(2-prop-1-en-2-ylphenyl)benzamide
CID 175134678
1-[(Z)-1,2-dichloroprop-1-enyl]-2-methoxybenzene
CID 118255169
2-[2-(2-methoxyphenyl)phenyl]benzoic acid
CID 67896375
1,2-bis(prop-1-en-2-yl)benzene;1,4-xylene
CID 143494216
1-[2-(2,3,4-trimethoxyphenyl)phenyl]ethanone
CID 61033108
1,2-diphenyl-3-prop-1-en-2-ylbenzene
CID 142394581

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene?
The IUPAC name of 1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene (CID 170148355) is 1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene.
What is the SMILES notation for 1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene?
The canonical SMILES for 1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene is C=C(C)c1ccccc1-c1cccc(OC)c1C.
What is the InChIKey of 1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene?
The InChIKey is FVBMFKDKWVFTOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O/c1-12(2)14-8-5-6-9-16(14)15-10-7-11-17(18-4)13(15)3/h5-11H,1H2,2-4H3.
What are the key properties of 1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene?
1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene has a molecular weight of 238.33 g/mol, XLogP of 4.70, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-methyl-3-(2-prop-1-en-2-ylphenyl)benzene is sourced from PubChem (CID 170148355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).