2-bromo-10-methylideneanthracen-9-one

C15H9BrO — CID 89197821

IUPAC2-bromo-10-methylideneanthracen-9-one
SMILESC=C1c2ccccc2C(=O)c2cc(Br)ccc21
InChIInChI=1S/C15H9BrO/c1-9-11-4-2-3-5-13(11)15(17)14-8-10(16)6-7-12(9)14/h2-8H,1H2
InChIKeyHVSRYJFNPZWGRX-UHFFFAOYSA-N
MW285.14 g/mol
LogP4.05
Rot. Bonds

About 2-bromo-10-methylideneanthracen-9-one

2-bromo-10-methylideneanthracen-9-one (PubChem CID 89197821) has the molecular formula C15H9BrO and a molecular weight of 285.14 g/mol. Its IUPAC name is 2-bromo-10-methylideneanthracen-9-one.

Molecular Properties

Compound Name2-bromo-10-methylideneanthracen-9-one
PubChem CID89197821
Molecular FormulaC15H9BrO
Molecular Weight285.14 g/mol
Exact Mass283.98
IUPAC Name2-bromo-10-methylideneanthracen-9-one
SMILESC=C1c2ccccc2C(=O)c2cc(Br)ccc21
InChIInChI=1S/C15H9BrO/c1-9-11-4-2-3-5-13(11)15(17)14-8-10(16)6-7-12(9)14/h2-8H,1H2
InChIKeyHVSRYJFNPZWGRX-UHFFFAOYSA-N
XLogP4.05
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.14
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-10-methylideneanthracen-9-one?
The IUPAC name of 2-bromo-10-methylideneanthracen-9-one (CID 89197821) is 2-bromo-10-methylideneanthracen-9-one.
What is the SMILES notation for 2-bromo-10-methylideneanthracen-9-one?
The canonical SMILES for 2-bromo-10-methylideneanthracen-9-one is C=C1c2ccccc2C(=O)c2cc(Br)ccc21.
What is the InChIKey of 2-bromo-10-methylideneanthracen-9-one?
The InChIKey is HVSRYJFNPZWGRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9BrO/c1-9-11-4-2-3-5-13(11)15(17)14-8-10(16)6-7-12(9)14/h2-8H,1H2.
What are the key properties of 2-bromo-10-methylideneanthracen-9-one?
2-bromo-10-methylideneanthracen-9-one has a molecular weight of 285.14 g/mol, XLogP of 4.05, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-10-methylideneanthracen-9-one is sourced from PubChem (CID 89197821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).