1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene

C16H16 — CID 20594776

IUPAC1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene
SMILESC=C(C)c1ccc(-c2ccc(C)cc2)cc1
InChIInChI=1S/C16H16/c1-12(2)14-8-10-16(11-9-14)15-6-4-13(3)5-7-15/h4-11H,1H2,2-3H3
InChIKeyWILUVNSNFUEBKC-UHFFFAOYSA-N
MW208.30 g/mol
LogP4.70
Rot. Bonds2

About 1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene

1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene (PubChem CID 20594776) has the molecular formula C16H16 and a molecular weight of 208.30 g/mol. Its IUPAC name is 1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene.

Molecular Properties

Compound Name1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene
PubChem CID20594776
Molecular FormulaC16H16
Molecular Weight208.30 g/mol
Exact Mass208.13
IUPAC Name1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene
SMILESC=C(C)c1ccc(-c2ccc(C)cc2)cc1
InChIInChI=1S/C16H16/c1-12(2)14-8-10-16(11-9-14)15-6-4-13(3)5-7-15/h4-11H,1H2,2-3H3
InChIKeyWILUVNSNFUEBKC-UHFFFAOYSA-N
XLogP4.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene?
The IUPAC name of 1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene (CID 20594776) is 1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene.
What is the SMILES notation for 1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene?
The canonical SMILES for 1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene is C=C(C)c1ccc(-c2ccc(C)cc2)cc1.
What is the InChIKey of 1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene?
The InChIKey is WILUVNSNFUEBKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16/c1-12(2)14-8-10-16(11-9-14)15-6-4-13(3)5-7-15/h4-11H,1H2,2-3H3.
What are the key properties of 1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene?
1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene has a molecular weight of 208.30 g/mol, XLogP of 4.70, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(4-prop-1-en-2-ylphenyl)benzene is sourced from PubChem (CID 20594776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).