1-benzyl-2-prop-1-en-2-ylbenzene

C16H16 — CID 12535340

IUPAC1-benzyl-2-prop-1-en-2-ylbenzene
SMILESC=C(C)c1ccccc1Cc1ccccc1
InChIInChI=1S/C16H16/c1-13(2)16-11-7-6-10-15(16)12-14-8-4-3-5-9-14/h3-11H,1,12H2,2H3
InChIKeyAJFOHVNOVLCDPT-UHFFFAOYSA-N
MW208.30 g/mol
LogP4.31
Rot. Bonds3

About 1-benzyl-2-prop-1-en-2-ylbenzene

1-benzyl-2-prop-1-en-2-ylbenzene (PubChem CID 12535340) has the molecular formula C16H16 and a molecular weight of 208.30 g/mol. Its IUPAC name is 1-benzyl-2-prop-1-en-2-ylbenzene.

Molecular Properties

Compound Name1-benzyl-2-prop-1-en-2-ylbenzene
PubChem CID12535340
Molecular FormulaC16H16
Molecular Weight208.30 g/mol
Exact Mass208.13
IUPAC Name1-benzyl-2-prop-1-en-2-ylbenzene
SMILESC=C(C)c1ccccc1Cc1ccccc1
InChIInChI=1S/C16H16/c1-13(2)16-11-7-6-10-15(16)12-14-8-4-3-5-9-14/h3-11H,1,12H2,2H3
InChIKeyAJFOHVNOVLCDPT-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[4-[(2-prop-1-en-2-ylphenyl)methyl]phenyl] thiohypofluorite
CID 146245909
1,2-bis(prop-1-en-2-yl)benzene;hydrogen peroxide
CID 175029396
3-benzyl-2-prop-1-en-2-ylbenzenethiol
CID 142100981
1-(2-prop-1-en-2-ylphenyl)propan-2-one
CID 68638096
2-benzylbenzenecarbothioyl chloride
CID 21317460
2-[(4-benzylphenyl)methyl]benzoic acid
CID 150682144
1,2-bis(prop-1-en-2-yl)benzene;propane
CID 142274191
N,N-dimethyl-1-(2-prop-1-en-2-ylphenyl)methanamine;ethane
CID 142073226
1-(2-benzylphenyl)-2-hydroxy-2-methylpropan-1-one
CID 159247184
1-(4-methylpentyl)-2-prop-1-en-2-ylbenzene
CID 177208667
lithium 1,2-bis(prop-1-en-2-yl)benzene
CID 22717015
2-benzylphenol;ethane
CID 91068983

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2-prop-1-en-2-ylbenzene?
The IUPAC name of 1-benzyl-2-prop-1-en-2-ylbenzene (CID 12535340) is 1-benzyl-2-prop-1-en-2-ylbenzene.
What is the SMILES notation for 1-benzyl-2-prop-1-en-2-ylbenzene?
The canonical SMILES for 1-benzyl-2-prop-1-en-2-ylbenzene is C=C(C)c1ccccc1Cc1ccccc1.
What is the InChIKey of 1-benzyl-2-prop-1-en-2-ylbenzene?
The InChIKey is AJFOHVNOVLCDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16/c1-13(2)16-11-7-6-10-15(16)12-14-8-4-3-5-9-14/h3-11H,1,12H2,2H3.
What are the key properties of 1-benzyl-2-prop-1-en-2-ylbenzene?
1-benzyl-2-prop-1-en-2-ylbenzene has a molecular weight of 208.30 g/mol, XLogP of 4.31, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2-prop-1-en-2-ylbenzene is sourced from PubChem (CID 12535340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).