methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene

C42H34 — CID 142384743

IUPACmethane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene
SMILESC.C.c1ccc2cc(-c3ccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc3)ccc2c1
InChIInChI=1S/C40H26.2CH4/c1-2-12-31-26-32(25-22-27(31)10-1)28-20-23-30(24-21-28)39-35-15-5-7-17-37(35)40(38-18-8-6-16-36(38)39)34-19-9-13-29-11-3-4-14-33(29)34;;/h1-26H;2*1H4
InChIKeyGNTVSNDFXWAODT-UHFFFAOYSA-N
MW538.73 g/mol
LogP12.57
Rot. Bonds3

About methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene

methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene (PubChem CID 142384743) has the molecular formula C42H34 and a molecular weight of 538.73 g/mol. Its IUPAC name is methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene.

Molecular Properties

Compound Namemethane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene
PubChem CID142384743
Molecular FormulaC42H34
Molecular Weight538.73 g/mol
Exact Mass538.27
IUPAC Namemethane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene
SMILESC.C.c1ccc2cc(-c3ccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc3)ccc2c1
InChIInChI=1S/C40H26.2CH4/c1-2-12-31-26-32(25-22-27(31)10-1)28-20-23-30(24-21-28)39-35-15-5-7-17-37(35)40(38-18-8-6-16-36(38)39)34-19-9-13-29-11-3-4-14-33(29)34;;/h1-26H;2*1H4
InChIKeyGNTVSNDFXWAODT-UHFFFAOYSA-N
XLogP12.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500538.73
LogP ≤ 512.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

10-naphthalen-1-yl-2-naphthalen-2-yl-9-(4-naphthalen-2-ylphenyl)anthracene
CID 58193908
9-naphthalen-1-yl-2,6-dinaphthalen-2-yl-10-(4-naphthalen-2-ylphenyl)anthracene
CID 159201170
9,10-dinaphthalen-1-ylanthracene;9,10-dinaphthalen-2-ylanthracene;9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-naphthalen-1-yl-10-(3-naphthalen-2-ylphenyl)anthracene;9-naphthalen-1-yl-10-(3-phenylphenyl)anthracene
CID 159190052
bis(9-naphthalen-1-yl-10-(3-naphthalen-2-ylphenyl)anthracene);9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene;9-naphthalen-1-yl-10-(6-phenylnaphthalen-2-yl)anthracene
CID 160765049
9-naphthalen-1-yl-10-(3-naphthalen-2-ylphenyl)anthracene;9-naphthalen-1-yl-10-[4-(3-naphthalen-2-ylphenyl)phenyl]anthracene;9-naphthalen-1-yl-10-[4-(3-phenylphenyl)phenyl]anthracene
CID 159702993
9-(4-naphthalen-2-ylphenyl)-10-[4-[5-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-1-yl]phenyl]anthracene
CID 59523732
10-naphthalen-1-yl-9-(4-naphthalen-2-ylphenyl)-2-phenylanthracene
CID 58322799
9-naphthalen-1-yl-10-(3-naphthalen-1-ylphenyl)anthracene;9-naphthalen-1-yl-10-(3-naphthalen-2-ylphenyl)anthracene;9-naphthalen-1-yl-10-(4-naphthalen-1-ylphenyl)anthracene;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene;9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracene;9-naphthalen-2-yl-10-(3-naphthalen-2-ylphenyl)anthracene;9-naphthalen-2-yl-10-(4-naphthalen-1-ylphenyl)anthracene;9-naphthalen-2-yl-10-(4-naphthalen-2-ylphenyl)anthracene
CID 157304390
9,10-dinaphthalen-1-yl-2-phenylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;10-naphthalen-1-yl-2-naphthalen-2-yl-9-phenylanthracene;9-naphthalen-1-yl-2-phenyl-10-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenyl-10-(4-phenylphenyl)anthracene;2-phenyl-9,10-bis(4-phenylphenyl)anthracene
CID 161337169
9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene
CID 160960650
9-naphthalen-1-yl-10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracene
CID 58876135
ethane;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene
CID 91401240

Frequently Asked Questions

What is the IUPAC name of methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene?
The IUPAC name of methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene (CID 142384743) is methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene.
What is the SMILES notation for methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene?
The canonical SMILES for methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene is C.C.c1ccc2cc(-c3ccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc3)ccc2c1.
What is the InChIKey of methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene?
The InChIKey is GNTVSNDFXWAODT-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H26.2CH4/c1-2-12-31-26-32(25-22-27(31)10-1)28-20-23-30(24-21-28)39-35-15-5-7-17-37(35)40(38-18-8-6-16-36(38)39)34-19-9-13-29-11-3-4-14-33(29)34;;/h1-26H;2*1H4.
What are the key properties of methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene?
methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene has a molecular weight of 538.73 g/mol, XLogP of 12.57, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene is sourced from PubChem (CID 142384743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).