ethane;1-methyl-2-(3-phenylphenyl)benzene

C21H22 — CID 142541189

IUPACethane;1-methyl-2-(3-phenylphenyl)benzene
SMILESCC.Cc1ccccc1-c1cccc(-c2ccccc2)c1
InChIInChI=1S/C19H16.C2H6/c1-15-8-5-6-13-19(15)18-12-7-11-17(14-18)16-9-3-2-4-10-16;1-2/h2-14H,1H3;1-2H3
InChIKeyKUEXGOZHWBDAMF-UHFFFAOYSA-N
MW274.41 g/mol
LogP6.36
Rot. Bonds2

About ethane;1-methyl-2-(3-phenylphenyl)benzene

ethane;1-methyl-2-(3-phenylphenyl)benzene (PubChem CID 142541189) has the molecular formula C21H22 and a molecular weight of 274.41 g/mol. Its IUPAC name is ethane;1-methyl-2-(3-phenylphenyl)benzene.

Molecular Properties

Compound Nameethane;1-methyl-2-(3-phenylphenyl)benzene
PubChem CID142541189
Molecular FormulaC21H22
Molecular Weight274.41 g/mol
Exact Mass274.17
IUPAC Nameethane;1-methyl-2-(3-phenylphenyl)benzene
SMILESCC.Cc1ccccc1-c1cccc(-c2ccccc2)c1
InChIInChI=1S/C19H16.C2H6/c1-15-8-5-6-13-19(15)18-12-7-11-17(14-18)16-9-3-2-4-10-16;1-2/h2-14H,1H3;1-2H3
InChIKeyKUEXGOZHWBDAMF-UHFFFAOYSA-N
XLogP6.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.41
LogP ≤ 56.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

ethane;1-methyl-2-(3-phenylphenyl)benzene;1-methyl-2-(4-phenylphenyl)benzene;1-methyl-3-(2-phenylphenyl)benzene;1-methyl-3-(3-phenylphenyl)benzene;1-methyl-3-(4-phenylphenyl)benzene;1-methyl-4-(3-phenylphenyl)benzene
CID 158292689
N-[4-[3-(2-methylphenyl)phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 146556750
1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene
CID 58892346
1,3-bis(4-methylphenyl)benzene;1,4-bis(4-methylphenyl)benzene;ethane;1-methyl-2-(2-methylphenyl)benzene;1-methyl-2-(3-methylphenyl)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(3-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-4-(4-methylphenyl)benzene
CID 158847391
ethane;1,3,5-tris(2-methylphenyl)benzene
CID 157145659
1-methyl-2-phenyl-3-(3-phenylphenyl)benzene
CID 59171668
1,1'-biphenyl;1-methyl-2-phenylbenzene;1-methyl-3-phenylbenzene
CID 159346959
1-methyl-2-(2-methylphenyl)-4-(3-phenylphenyl)benzene
CID 143578929
1-methyl-2-[3-[4-[2-(3-methylphenyl)phenyl]phenyl]phenyl]benzene
CID 153455101
2-methyl-1,3-bis(3-phenylphenyl)benzene
CID 162497496
1-methyl-2-[4-(4-phenylphenyl)phenyl]benzene
CID 58389745
1-methyl-2-(4-phenylphenyl)benzene
CID 144588078

Frequently Asked Questions

What is the IUPAC name of ethane;1-methyl-2-(3-phenylphenyl)benzene?
The IUPAC name of ethane;1-methyl-2-(3-phenylphenyl)benzene (CID 142541189) is ethane;1-methyl-2-(3-phenylphenyl)benzene.
What is the SMILES notation for ethane;1-methyl-2-(3-phenylphenyl)benzene?
The canonical SMILES for ethane;1-methyl-2-(3-phenylphenyl)benzene is CC.Cc1ccccc1-c1cccc(-c2ccccc2)c1.
What is the InChIKey of ethane;1-methyl-2-(3-phenylphenyl)benzene?
The InChIKey is KUEXGOZHWBDAMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16.C2H6/c1-15-8-5-6-13-19(15)18-12-7-11-17(14-18)16-9-3-2-4-10-16;1-2/h2-14H,1H3;1-2H3.
What are the key properties of ethane;1-methyl-2-(3-phenylphenyl)benzene?
ethane;1-methyl-2-(3-phenylphenyl)benzene has a molecular weight of 274.41 g/mol, XLogP of 6.36, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methyl-2-(3-phenylphenyl)benzene is sourced from PubChem (CID 142541189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).