2-phenylpropan-2-ylbenzene

C15H16 — CID 13065

IUPAC2-phenylpropan-2-ylbenzene
SMILESCC(C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H16/c1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKeyMILSYCKGLDDVLM-UHFFFAOYSA-N
MW196.29 g/mol
LogP4.01
Rot. Bonds2

About 2-phenylpropan-2-ylbenzene

2-phenylpropan-2-ylbenzene (PubChem CID 13065) has the molecular formula C15H16 and a molecular weight of 196.29 g/mol. Its IUPAC name is 2-phenylpropan-2-ylbenzene.

Molecular Properties

Compound Name2-phenylpropan-2-ylbenzene
PubChem CID13065
Molecular FormulaC15H16
Molecular Weight196.29 g/mol
Exact Mass196.13
IUPAC Name2-phenylpropan-2-ylbenzene
SMILESCC(C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H16/c1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKeyMILSYCKGLDDVLM-UHFFFAOYSA-N
XLogP4.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

CID 171375456
CID 171375456
dimethyl(diphenyl)silane;2-phenylpropan-2-ylbenzene
CID 159821402
copper;tetrakis(4-(2-phenylpropan-2-yl)phenol)
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3,5-bis(2-phenylpropan-2-yl)aniline
CID 142144538
trihydroxy-[4-(2-phenylpropan-2-yl)phenyl]phosphanium
CID 175105136
1-methyl-4-(2-phenylpropan-2-yl)benzene;1-methyl-4-[2-[3-(2-phenylpropan-2-yl)phenyl]propan-2-yl]benzene;1-methyl-4-[2-[4-(2-phenylpropan-2-yl)phenyl]propan-2-yl]benzene
CID 159818582
3-(2-phenylpropan-2-yl)-1H-pyrrole
CID 101002559
benzene;tert-butylbenzene;bis(2,2-dimethylpropane);ethane
CID 158670454
tert-butylbenzene;chloromethane;ethane
CID 91149652
tert-butylbenzene;2,2-dimethylpropane;methane
CID 160959011
(1-bromo-1-phenylethyl)benzene
CID 19019197
tert-butylbenzene;molecular nitrogen
CID 146464751

Frequently Asked Questions

What is the IUPAC name of 2-phenylpropan-2-ylbenzene?
The IUPAC name of 2-phenylpropan-2-ylbenzene (CID 13065) is 2-phenylpropan-2-ylbenzene.
What is the SMILES notation for 2-phenylpropan-2-ylbenzene?
The canonical SMILES for 2-phenylpropan-2-ylbenzene is CC(C)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-phenylpropan-2-ylbenzene?
The InChIKey is MILSYCKGLDDVLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16/c1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3.
What are the key properties of 2-phenylpropan-2-ylbenzene?
2-phenylpropan-2-ylbenzene has a molecular weight of 196.29 g/mol, XLogP of 4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylpropan-2-ylbenzene is sourced from PubChem (CID 13065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).