2-phenylnaphthalene

C16H12 — CID 11934

IUPAC2-phenylnaphthalene
SMILESc1ccc(-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C16H12/c1-2-6-13(7-3-1)16-11-10-14-8-4-5-9-15(14)12-16/h1-12H
InChIKeyTURIHPLQSRVWHU-UHFFFAOYSA-N
MW204.27 g/mol
LogP4.51
Rot. Bonds1

About 2-phenylnaphthalene

2-phenylnaphthalene (PubChem CID 11934) has the molecular formula C16H12 and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-phenylnaphthalene.

Molecular Properties

Compound Name2-phenylnaphthalene
PubChem CID11934
Molecular FormulaC16H12
Molecular Weight204.27 g/mol
Exact Mass204.09
IUPAC Name2-phenylnaphthalene
SMILESc1ccc(-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C16H12/c1-2-6-13(7-3-1)16-11-10-14-8-4-5-9-15(14)12-16/h1-12H
InChIKeyTURIHPLQSRVWHU-UHFFFAOYSA-N
XLogP4.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Naphthalene
CID 931
Benzo[a]pyrene
CID 2336
Anthracene
CID 8418
Phenanthrene
CID 995
Pyrene
CID 31423
1-Methylnaphthalene
CID 7002
3-Methylcholanthrene
CID 1674
BENZ(a)ANTHRACENE
CID 5954
Benzo(E)Pyrene
CID 9128
Benzo(B)Fluoranthene
CID 9153
Fluoranthene
CID 9154
Benzo(K)Fluoranthene
CID 9158

Frequently Asked Questions

What is the IUPAC name of 2-phenylnaphthalene?
The IUPAC name of 2-phenylnaphthalene (CID 11934) is 2-phenylnaphthalene.
What is the SMILES notation for 2-phenylnaphthalene?
The canonical SMILES for 2-phenylnaphthalene is c1ccc(-c2ccc3ccccc3c2)cc1.
What is the InChIKey of 2-phenylnaphthalene?
The InChIKey is TURIHPLQSRVWHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12/c1-2-6-13(7-3-1)16-11-10-14-8-4-5-9-15(14)12-16/h1-12H.
What are the key properties of 2-phenylnaphthalene?
2-phenylnaphthalene has a molecular weight of 204.27 g/mol, XLogP of 4.51, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylnaphthalene is sourced from PubChem (CID 11934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).