2-naphthalen-1-yl-3-phenylanthracene

C30H20 — CID 123533450

IUPAC2-naphthalen-1-yl-3-phenylanthracene
SMILESc1ccc(-c2cc3cc4ccccc4cc3cc2-c2cccc3ccccc23)cc1
InChIInChI=1S/C30H20/c1-2-9-22(10-3-1)29-19-25-17-23-12-4-5-13-24(23)18-26(25)20-30(29)28-16-8-14-21-11-6-7-15-27(21)28/h1-20H
InChIKeyCSILCNSSZQWKHH-UHFFFAOYSA-N
MW380.49 g/mol
LogP8.48
Rot. Bonds2

About 2-naphthalen-1-yl-3-phenylanthracene

2-naphthalen-1-yl-3-phenylanthracene (PubChem CID 123533450) has the molecular formula C30H20 and a molecular weight of 380.49 g/mol. Its IUPAC name is 2-naphthalen-1-yl-3-phenylanthracene.

Molecular Properties

Compound Name2-naphthalen-1-yl-3-phenylanthracene
PubChem CID123533450
Molecular FormulaC30H20
Molecular Weight380.49 g/mol
Exact Mass380.16
IUPAC Name2-naphthalen-1-yl-3-phenylanthracene
SMILESc1ccc(-c2cc3cc4ccccc4cc3cc2-c2cccc3ccccc23)cc1
InChIInChI=1S/C30H20/c1-2-9-22(10-3-1)29-19-25-17-23-12-4-5-13-24(23)18-26(25)20-30(29)28-16-8-14-21-11-6-7-15-27(21)28/h1-20H
InChIKeyCSILCNSSZQWKHH-UHFFFAOYSA-N
XLogP8.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.49
LogP ≤ 58.48
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

3-(9,10-diphenylbenzo[k]fluoranthen-3-yl)-9,10-diphenylbenzo[k]fluoranthene
CID 58988796
9-naphthalen-2-yl-10-(4-naphthalen-1-yl-3-phenylphenyl)anthracene
CID 58856517
1-(2-phenylphenyl)anthracene
CID 21435778
2,3-dinaphthalen-1-yl-1-phenylanthracene
CID 151512335
1-(4-chloro-2-phenylphenyl)naphthalene
CID 163255490
2-naphthalen-1-ylanthracene
CID 2748705
1,6-dinaphthalen-1-yl-3,8-diphenylpyrene
CID 59391123
1-(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123841203
1,4-bis[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123399401
4-benzo[a]anthracen-11-yl-11-(11-benzo[a]anthracen-11-ylbenzo[a]anthracen-4-yl)benzo[a]anthracene;4-naphthalen-1-yl-11-[4-[4-(4-naphthalen-1-ylbenzo[a]anthracen-11-yl)benzo[a]anthracen-11-yl]benzo[a]anthracen-11-yl]benzo[a]anthracene;4-phenyl-11-[4-[4-(4-phenylbenzo[a]anthracen-11-yl)benzo[a]anthracen-11-yl]benzo[a]anthracen-11-yl]benzo[a]anthracene
CID 159785765
4-naphthalen-1-yl-N,N-bis(4-naphthalen-1-yl-3-phenylphenyl)-3-phenylaniline
CID 122470453
5-phenyl-1-(3-phenylnaphthalen-2-yl)pyrene
CID 91537355

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-3-phenylanthracene?
The IUPAC name of 2-naphthalen-1-yl-3-phenylanthracene (CID 123533450) is 2-naphthalen-1-yl-3-phenylanthracene.
What is the SMILES notation for 2-naphthalen-1-yl-3-phenylanthracene?
The canonical SMILES for 2-naphthalen-1-yl-3-phenylanthracene is c1ccc(-c2cc3cc4ccccc4cc3cc2-c2cccc3ccccc23)cc1.
What is the InChIKey of 2-naphthalen-1-yl-3-phenylanthracene?
The InChIKey is CSILCNSSZQWKHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20/c1-2-9-22(10-3-1)29-19-25-17-23-12-4-5-13-24(23)18-26(25)20-30(29)28-16-8-14-21-11-6-7-15-27(21)28/h1-20H.
What are the key properties of 2-naphthalen-1-yl-3-phenylanthracene?
2-naphthalen-1-yl-3-phenylanthracene has a molecular weight of 380.49 g/mol, XLogP of 8.48, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-3-phenylanthracene is sourced from PubChem (CID 123533450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).