hydron;1-phenylanthracene

C20H15+ — CID 174351162

IUPAChydron;1-phenylanthracene
SMILES[H+].c1ccc(-c2cccc3cc4ccccc4cc23)cc1
InChIInChI=1S/C20H14/c1-2-7-15(8-3-1)19-12-6-11-18-13-16-9-4-5-10-17(16)14-20(18)19/h1-14H/p+1
InChIKeyBRSRUYVJULRMRQ-UHFFFAOYSA-O
MW255.34 g/mol
LogP5.77
Rot. Bonds1

About hydron;1-phenylanthracene

hydron;1-phenylanthracene (PubChem CID 174351162) has the molecular formula C20H15+ and a molecular weight of 255.34 g/mol. Its IUPAC name is hydron;1-phenylanthracene.

Molecular Properties

Compound Namehydron;1-phenylanthracene
PubChem CID174351162
Molecular FormulaC20H15+
Molecular Weight255.34 g/mol
Exact Mass255.12
IUPAC Namehydron;1-phenylanthracene
SMILES[H+].c1ccc(-c2cccc3cc4ccccc4cc23)cc1
InChIInChI=1S/C20H14/c1-2-7-15(8-3-1)19-12-6-11-18-13-16-9-4-5-10-17(16)14-20(18)19/h1-14H/p+1
InChIKeyBRSRUYVJULRMRQ-UHFFFAOYSA-O
XLogP5.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500255.34
LogP ≤ 55.77
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

1-(2-phenylphenyl)anthracene
CID 21435778
1-(2,3-diphenylphenyl)anthracene
CID 151584978
4-anthracen-1-ylaniline
CID 18974595
11-phenylbenzo[a]anthracene
CID 123665695
1-(4-bromophenyl)anthracene
CID 141156344
4-(4-benzo[a]anthracen-4-ylphenyl)benzo[a]anthracene
CID 59412541
5-phenylnaphthalene-2,3-diol
CID 21407140
5-phenylnaphthalene-2,3-diamine
CID 70378591
2-deuterio-1-phenylanthracene
CID 162719950
4-anthracen-1-ylbenzonitrile
CID 151714314
1,4,8,11-tetraphenylpentacene
CID 102295223
1-(3,4,5-trifluorophenyl)anthracene
CID 87425952

Frequently Asked Questions

What is the IUPAC name of hydron;1-phenylanthracene?
The IUPAC name of hydron;1-phenylanthracene (CID 174351162) is hydron;1-phenylanthracene.
What is the SMILES notation for hydron;1-phenylanthracene?
The canonical SMILES for hydron;1-phenylanthracene is [H+].c1ccc(-c2cccc3cc4ccccc4cc23)cc1.
What is the InChIKey of hydron;1-phenylanthracene?
The InChIKey is BRSRUYVJULRMRQ-UHFFFAOYSA-O. The full InChI is InChI=1S/C20H14/c1-2-7-15(8-3-1)19-12-6-11-18-13-16-9-4-5-10-17(16)14-20(18)19/h1-14H/p+1.
What are the key properties of hydron;1-phenylanthracene?
hydron;1-phenylanthracene has a molecular weight of 255.34 g/mol, XLogP of 5.77, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;1-phenylanthracene is sourced from PubChem (CID 174351162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).