1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene

C27H20 — CID 11739441

IUPAC1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene
SMILESCc1ccc2ccccc2c1-c1c(-c2ccccc2)ccc2ccccc12
InChIInChI=1S/C27H20/c1-19-15-16-21-11-5-7-13-23(21)26(19)27-24-14-8-6-12-22(24)17-18-25(27)20-9-3-2-4-10-20/h2-18H,1H3
InChIKeySASJPYMMTBWBPD-UHFFFAOYSA-N
MW344.46 g/mol
LogP7.64
Rot. Bonds2

About 1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene

1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene (PubChem CID 11739441) has the molecular formula C27H20 and a molecular weight of 344.46 g/mol. Its IUPAC name is 1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene.

Molecular Properties

Compound Name1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene
PubChem CID11739441
Molecular FormulaC27H20
Molecular Weight344.46 g/mol
Exact Mass344.16
IUPAC Name1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene
SMILESCc1ccc2ccccc2c1-c1c(-c2ccccc2)ccc2ccccc12
InChIInChI=1S/C27H20/c1-19-15-16-21-11-5-7-13-23(21)26(19)27-24-14-8-6-12-22(24)17-18-25(27)20-9-3-2-4-10-20/h2-18H,1H3
InChIKeySASJPYMMTBWBPD-UHFFFAOYSA-N
XLogP7.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.46
LogP ≤ 57.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene?
The IUPAC name of 1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene (CID 11739441) is 1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene.
What is the SMILES notation for 1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene?
The canonical SMILES for 1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene is Cc1ccc2ccccc2c1-c1c(-c2ccccc2)ccc2ccccc12.
What is the InChIKey of 1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene?
The InChIKey is SASJPYMMTBWBPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20/c1-19-15-16-21-11-5-7-13-23(21)26(19)27-24-14-8-6-12-22(24)17-18-25(27)20-9-3-2-4-10-20/h2-18H,1H3.
What are the key properties of 1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene?
1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene has a molecular weight of 344.46 g/mol, XLogP of 7.64, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene is sourced from PubChem (CID 11739441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).