1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene

C11H14O — CID 89073542

IUPAC1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene
SMILESC/C=C\c1cc(C)cc(OC)c1
InChIInChI=1S/C11H14O/c1-4-5-10-6-9(2)7-11(8-10)12-3/h4-8H,1-3H3/b5-4-
InChIKeyZZFFSHSZYWDHDU-PLNGDYQASA-N
MW162.23 g/mol
LogP3.04
Rot. Bonds2

About 1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene

1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene (PubChem CID 89073542) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is 1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene.

Molecular Properties

Compound Name1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene
PubChem CID89073542
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene
SMILESC/C=C\c1cc(C)cc(OC)c1
InChIInChI=1S/C11H14O/c1-4-5-10-6-9(2)7-11(8-10)12-3/h4-8H,1-3H3/b5-4-
InChIKeyZZFFSHSZYWDHDU-PLNGDYQASA-N
XLogP3.04
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene?
The IUPAC name of 1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene (CID 89073542) is 1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene.
What is the SMILES notation for 1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene?
The canonical SMILES for 1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene is C/C=C\c1cc(C)cc(OC)c1.
What is the InChIKey of 1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene?
The InChIKey is ZZFFSHSZYWDHDU-PLNGDYQASA-N. The full InChI is InChI=1S/C11H14O/c1-4-5-10-6-9(2)7-11(8-10)12-3/h4-8H,1-3H3/b5-4-.
What are the key properties of 1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene?
1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene has a molecular weight of 162.23 g/mol, XLogP of 3.04, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-methyl-5-[(Z)-prop-1-enyl]benzene is sourced from PubChem (CID 89073542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).