4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane

C15H23Br — CID 142150978

IUPAC4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane
SMILESC=Cc1ccc(Br)cc1/C=C\C.CC.CC
InChIInChI=1S/C11H11Br.2C2H6/c1-3-5-10-8-11(12)7-6-9(10)4-2;2*1-2/h3-8H,2H2,1H3;2*1-2H3/b5-3-;;
InChIKeyLKALEOLGNAAREP-ORIPCLHRSA-N
MW283.25 g/mol
LogP6.18
Rot. Bonds2

About 4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane

4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane (PubChem CID 142150978) has the molecular formula C15H23Br and a molecular weight of 283.25 g/mol. Its IUPAC name is 4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane.

Molecular Properties

Compound Name4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane
PubChem CID142150978
Molecular FormulaC15H23Br
Molecular Weight283.25 g/mol
Exact Mass282.10
IUPAC Name4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane
SMILESC=Cc1ccc(Br)cc1/C=C\C.CC.CC
InChIInChI=1S/C11H11Br.2C2H6/c1-3-5-10-8-11(12)7-6-9(10)4-2;2*1-2/h3-8H,2H2,1H3;2*1-2H3/b5-3-;;
InChIKeyLKALEOLGNAAREP-ORIPCLHRSA-N
XLogP6.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.25
LogP ≤ 56.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;1-ethenyl-4-methyl-2-[(Z)-prop-1-enyl]benzene;methane
CID 143188972
2,4-dibromo-1-prop-1-enylbenzene
CID 139726331
N-[4-bromo-2-[(Z)-prop-1-enyl]phenyl]methanimine
CID 135128411
ethane;2-ethenyl-4-methyl-1-[(Z)-prop-1-enyl]benzene
CID 172609650
1-[4-ethenyl-3-[(Z)-prop-1-enyl]phenyl]ethanone
CID 143306088
ethane;1-ethenyl-2-[(Z)-prop-1-enyl]benzene;methylphosphane;propane
CID 142250050
ethane;5-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]pyridine
CID 143821752
2-ethenyl-4-propan-2-yl-1-[(Z)-prop-1-enyl]benzene
CID 142382594
[3-ethenyl-4-[(Z)-prop-1-enyl]phenyl]boronic acid
CID 142377841
2-chloro-1-ethenyl-3-methyl-4-[(Z)-prop-1-enyl]benzene
CID 153376323
1,2-bis(ethenyl)-4-methylbenzene;ethane;prop-1-ene
CID 143109354
6-bromo-3-ethenyl-2-[(Z)-prop-1-enyl]benzaldehyde
CID 143407181

Frequently Asked Questions

What is the IUPAC name of 4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane?
The IUPAC name of 4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane (CID 142150978) is 4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane.
What is the SMILES notation for 4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane?
The canonical SMILES for 4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane is C=Cc1ccc(Br)cc1/C=C\C.CC.CC.
What is the InChIKey of 4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane?
The InChIKey is LKALEOLGNAAREP-ORIPCLHRSA-N. The full InChI is InChI=1S/C11H11Br.2C2H6/c1-3-5-10-8-11(12)7-6-9(10)4-2;2*1-2/h3-8H,2H2,1H3;2*1-2H3/b5-3-;;.
What are the key properties of 4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane?
4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane has a molecular weight of 283.25 g/mol, XLogP of 6.18, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-1-ethenyl-2-[(Z)-prop-1-enyl]benzene;ethane is sourced from PubChem (CID 142150978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).