1,2,3,4,5,6,7,8,9,10-decamethylanthracene

C24H30 — CID 5225193

IUPAC1,2,3,4,5,6,7,8,9,10-decamethylanthracene
SMILESCc1c(C)c(C)c2c(C)c3c(C)c(C)c(C)c(C)c3c(C)c2c1C
InChIInChI=1S/C24H30/c1-11-12(2)16(6)22-20(10)24-18(8)14(4)13(3)17(7)23(24)19(9)21(22)15(11)5/h1-10H3
InChIKeyPJPWHAXWJUGWMD-UHFFFAOYSA-N
MW318.50 g/mol
LogP7.08
Rot. Bonds

About 1,2,3,4,5,6,7,8,9,10-decamethylanthracene

1,2,3,4,5,6,7,8,9,10-decamethylanthracene (PubChem CID 5225193) has the molecular formula C24H30 and a molecular weight of 318.50 g/mol. Its IUPAC name is 1,2,3,4,5,6,7,8,9,10-decamethylanthracene.

Molecular Properties

Compound Name1,2,3,4,5,6,7,8,9,10-decamethylanthracene
PubChem CID5225193
Molecular FormulaC24H30
Molecular Weight318.50 g/mol
Exact Mass318.23
IUPAC Name1,2,3,4,5,6,7,8,9,10-decamethylanthracene
SMILESCc1c(C)c(C)c2c(C)c3c(C)c(C)c(C)c(C)c3c(C)c2c1C
InChIInChI=1S/C24H30/c1-11-12(2)16(6)22-20(10)24-18(8)14(4)13(3)17(7)23(24)19(9)21(22)15(11)5/h1-10H3
InChIKeyPJPWHAXWJUGWMD-UHFFFAOYSA-N
XLogP7.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.50
LogP ≤ 57.08
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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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,6,7,8,9,10-decamethylanthracene?
The IUPAC name of 1,2,3,4,5,6,7,8,9,10-decamethylanthracene (CID 5225193) is 1,2,3,4,5,6,7,8,9,10-decamethylanthracene.
What is the SMILES notation for 1,2,3,4,5,6,7,8,9,10-decamethylanthracene?
The canonical SMILES for 1,2,3,4,5,6,7,8,9,10-decamethylanthracene is Cc1c(C)c(C)c2c(C)c3c(C)c(C)c(C)c(C)c3c(C)c2c1C.
What is the InChIKey of 1,2,3,4,5,6,7,8,9,10-decamethylanthracene?
The InChIKey is PJPWHAXWJUGWMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30/c1-11-12(2)16(6)22-20(10)24-18(8)14(4)13(3)17(7)23(24)19(9)21(22)15(11)5/h1-10H3.
What are the key properties of 1,2,3,4,5,6,7,8,9,10-decamethylanthracene?
1,2,3,4,5,6,7,8,9,10-decamethylanthracene has a molecular weight of 318.50 g/mol, XLogP of 7.08, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,6,7,8,9,10-decamethylanthracene is sourced from PubChem (CID 5225193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).