4-methyl-1,2-bis(prop-1-enyl)benzene

C13H16 — CID 123860463

IUPAC4-methyl-1,2-bis(prop-1-enyl)benzene
SMILESCC=Cc1ccc(C)cc1C=CC
InChIInChI=1S/C13H16/c1-4-6-12-9-8-11(3)10-13(12)7-5-2/h4-10H,1-3H3
InChIKeyRCEUYOMQEHADCG-UHFFFAOYSA-N
MW172.27 g/mol
LogP4.06
Rot. Bonds2

About 4-methyl-1,2-bis(prop-1-enyl)benzene

4-methyl-1,2-bis(prop-1-enyl)benzene (PubChem CID 123860463) has the molecular formula C13H16 and a molecular weight of 172.27 g/mol. Its IUPAC name is 4-methyl-1,2-bis(prop-1-enyl)benzene.

Molecular Properties

Compound Name4-methyl-1,2-bis(prop-1-enyl)benzene
PubChem CID123860463
Molecular FormulaC13H16
Molecular Weight172.27 g/mol
Exact Mass172.13
IUPAC Name4-methyl-1,2-bis(prop-1-enyl)benzene
SMILESCC=Cc1ccc(C)cc1C=CC
InChIInChI=1S/C13H16/c1-4-6-12-9-8-11(3)10-13(12)7-5-2/h4-10H,1-3H3
InChIKeyRCEUYOMQEHADCG-UHFFFAOYSA-N
XLogP4.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

ethane;2-ethenyl-4-methyl-1-[(Z)-prop-1-enyl]benzene
CID 172609650
ethane;1-ethenyl-4-methyl-2-[(Z)-prop-1-enyl]benzene;methane
CID 143188972
4-[(E)-2-[5-methyl-2-[(E)-prop-1-enyl]phenyl]ethenyl]pyridine
CID 167189739
4-methyl-2-[(Z)-prop-1-enyl]-1-prop-1-ynylbenzene
CID 176574438
2-ethynyl-4-methyl-1-[(Z)-prop-1-enyl]benzene
CID 153376187
1-[4-methyl-2-[(Z)-prop-1-enyl]phenyl]ethanethione
CID 144945000
ethane;4-methyl-2-[(Z)-prop-1-enyl]-1-prop-1-ynylbenzene
CID 176574437
2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine
CID 90050951
5-(4-methyl-2-prop-1-enylphenyl)-1H-pyrazole
CID 174386945
1,2-bis(ethenyl)-4-methylbenzene;ethane;prop-1-ene
CID 143109354
1,2-bis(ethenyl)-4-methylbenzene;ethane;methane;prop-1-ene
CID 143109411
2-[5-(4-methylphenyl)-2-[(Z)-prop-1-enyl]phenyl]pyridine
CID 118204402

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1,2-bis(prop-1-enyl)benzene?
The IUPAC name of 4-methyl-1,2-bis(prop-1-enyl)benzene (CID 123860463) is 4-methyl-1,2-bis(prop-1-enyl)benzene.
What is the SMILES notation for 4-methyl-1,2-bis(prop-1-enyl)benzene?
The canonical SMILES for 4-methyl-1,2-bis(prop-1-enyl)benzene is CC=Cc1ccc(C)cc1C=CC.
What is the InChIKey of 4-methyl-1,2-bis(prop-1-enyl)benzene?
The InChIKey is RCEUYOMQEHADCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16/c1-4-6-12-9-8-11(3)10-13(12)7-5-2/h4-10H,1-3H3.
What are the key properties of 4-methyl-1,2-bis(prop-1-enyl)benzene?
4-methyl-1,2-bis(prop-1-enyl)benzene has a molecular weight of 172.27 g/mol, XLogP of 4.06, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1,2-bis(prop-1-enyl)benzene is sourced from PubChem (CID 123860463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).