2,9-dimethyl-10-phenylanthracene

C22H18 — CID 58435289

IUPAC2,9-dimethyl-10-phenylanthracene
SMILESCc1ccc2c(-c3ccccc3)c3ccccc3c(C)c2c1
InChIInChI=1S/C22H18/c1-15-12-13-20-21(14-15)16(2)18-10-6-7-11-19(18)22(20)17-8-4-3-5-9-17/h3-14H,1-2H3
InChIKeySRFFZCSRTCWHMD-UHFFFAOYSA-N
MW282.39 g/mol
LogP6.28
Rot. Bonds1

About 2,9-dimethyl-10-phenylanthracene

2,9-dimethyl-10-phenylanthracene (PubChem CID 58435289) has the molecular formula C22H18 and a molecular weight of 282.39 g/mol. Its IUPAC name is 2,9-dimethyl-10-phenylanthracene.

Molecular Properties

Compound Name2,9-dimethyl-10-phenylanthracene
PubChem CID58435289
Molecular FormulaC22H18
Molecular Weight282.39 g/mol
Exact Mass282.14
IUPAC Name2,9-dimethyl-10-phenylanthracene
SMILESCc1ccc2c(-c3ccccc3)c3ccccc3c(C)c2c1
InChIInChI=1S/C22H18/c1-15-12-13-20-21(14-15)16(2)18-10-6-7-11-19(18)22(20)17-8-4-3-5-9-17/h3-14H,1-2H3
InChIKeySRFFZCSRTCWHMD-UHFFFAOYSA-N
XLogP6.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.39
LogP ≤ 56.28
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

2,5-dimethyl-12-phenyltetracene
CID 160669382
9-methyl-10-(4-methylphenyl)anthracene
CID 159479529
9,10-diphenylanthracene;ethane;9-methyl-10-phenylanthracene
CID 143856164
9-methyl-10-(4-phenylphenyl)anthracene
CID 58820618
9-(4-methylphenyl)-10-phenylanthracene
CID 631292
2-methylnaphthalene;9-methyl-10-(4-phenylphenyl)anthracene;toluene
CID 143494695
2,9,10-trimethylphenanthrene
CID 11345039
9-chloro-2,6-dimethyl-10-phenylanthracene
CID 58351152
2-methyl-9,10-bis(4-methylphenyl)phenanthrene
CID 102170161
9-methyl-10-(3-phenylphenyl)anthracene
CID 58599979
9-(3,5-dimethylphenyl)-10-phenylanthracene
CID 170561654
2-[4-(3-methyl-10-phenylanthracen-9-yl)phenyl]-5-phenyl-1,3,4-oxadiazole
CID 59501428

Frequently Asked Questions

What is the IUPAC name of 2,9-dimethyl-10-phenylanthracene?
The IUPAC name of 2,9-dimethyl-10-phenylanthracene (CID 58435289) is 2,9-dimethyl-10-phenylanthracene.
What is the SMILES notation for 2,9-dimethyl-10-phenylanthracene?
The canonical SMILES for 2,9-dimethyl-10-phenylanthracene is Cc1ccc2c(-c3ccccc3)c3ccccc3c(C)c2c1.
What is the InChIKey of 2,9-dimethyl-10-phenylanthracene?
The InChIKey is SRFFZCSRTCWHMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18/c1-15-12-13-20-21(14-15)16(2)18-10-6-7-11-19(18)22(20)17-8-4-3-5-9-17/h3-14H,1-2H3.
What are the key properties of 2,9-dimethyl-10-phenylanthracene?
2,9-dimethyl-10-phenylanthracene has a molecular weight of 282.39 g/mol, XLogP of 6.28, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,9-dimethyl-10-phenylanthracene is sourced from PubChem (CID 58435289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).