methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene

C38H32 — CID 142335654

IUPACmethane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene
SMILESC.Cc1cccc(-c2cc(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c2-c2ccccc2)c1
InChIInChI=1S/C37H28.CH4/c1-27-15-14-24-32(25-27)34-26-33(28-16-6-2-7-17-28)35(29-18-8-3-9-19-29)37(31-22-12-5-13-23-31)36(34)30-20-10-4-11-21-30;/h2-26H,1H3;1H4
InChIKeyNASYRRQHSPWSAA-UHFFFAOYSA-N
MW488.67 g/mol
LogP10.97
Rot. Bonds5

About methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene

methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene (PubChem CID 142335654) has the molecular formula C38H32 and a molecular weight of 488.67 g/mol. Its IUPAC name is methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene.

Molecular Properties

Compound Namemethane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene
PubChem CID142335654
Molecular FormulaC38H32
Molecular Weight488.67 g/mol
Exact Mass488.25
IUPAC Namemethane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene
SMILESC.Cc1cccc(-c2cc(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c2-c2ccccc2)c1
InChIInChI=1S/C37H28.CH4/c1-27-15-14-24-32(25-27)34-26-33(28-16-6-2-7-17-28)35(29-18-8-3-9-19-29)37(31-22-12-5-13-23-31)36(34)30-20-10-4-11-21-30;/h2-26H,1H3;1H4
InChIKeyNASYRRQHSPWSAA-UHFFFAOYSA-N
XLogP10.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500488.67
LogP ≤ 510.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,2-bis[3-(3-methylphenyl)phenyl]-4,5-diphenylbenzene
CID 59552772
methane;1,2,3,4,5-pentakis-phenylbenzene;1,2,4,5-tetraphenylbenzene
CID 161142859
1-(3-methylphenyl)-3-phenyl-2,5-bis[4-(2-phenylethynyl)phenyl]-4-[4-[4-[2-phenyl-4-[3-(2-phenylethynyl)phenyl]-3,6-bis[4-(2-phenylethynyl)phenyl]phenyl]phenoxy]phenyl]benzene
CID 155654792
ethane;methane;1-methyl-3-phenylbenzene
CID 144644852
2-(3-methylphenyl)-6-phenylaniline
CID 150906011
3,4-bis(3-methylphenyl)-1-N,2-N,6-triphenylbenzene-1,2-diamine
CID 141084699
4-(3-methylphenyl)-1,2-diphenylbenzene
CID 59171658
1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 58879503
ethane;1-methyl-3-phenylbenzene
CID 142040878
1,1'-biphenyl;1-methyl-2-phenylbenzene;1-methyl-3-phenylbenzene
CID 159346959
1-(3-methylphenyl)-3-phenyl-5-(3-phenylphenyl)benzene
CID 123280286
ethane;1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 142439051

Frequently Asked Questions

What is the IUPAC name of methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene?
The IUPAC name of methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene (CID 142335654) is methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene.
What is the SMILES notation for methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene?
The canonical SMILES for methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene is C.Cc1cccc(-c2cc(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c2-c2ccccc2)c1.
What is the InChIKey of methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene?
The InChIKey is NASYRRQHSPWSAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H28.CH4/c1-27-15-14-24-32(25-27)34-26-33(28-16-6-2-7-17-28)35(29-18-8-3-9-19-29)37(31-22-12-5-13-23-31)36(34)30-20-10-4-11-21-30;/h2-26H,1H3;1H4.
What are the key properties of methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene?
methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene has a molecular weight of 488.67 g/mol, XLogP of 10.97, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene is sourced from PubChem (CID 142335654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).