2,7-dibromo-4-methoxyfluoren-9-one

C14H8Br2O2 — CID 175173621

IUPAC2,7-dibromo-4-methoxyfluoren-9-one
SMILESCOc1cc(Br)cc2c1-c1ccc(Br)cc1C2=O
InChIInChI=1S/C14H8Br2O2/c1-18-12-6-8(16)5-11-13(12)9-3-2-7(15)4-10(9)14(11)17/h2-6H,1H3
InChIKeyYQBAOJQDQUZKFR-UHFFFAOYSA-N
MW368.02 g/mol
LogP4.43
Rot. Bonds1

About 2,7-dibromo-4-methoxyfluoren-9-one

2,7-dibromo-4-methoxyfluoren-9-one (PubChem CID 175173621) has the molecular formula C14H8Br2O2 and a molecular weight of 368.02 g/mol. Its IUPAC name is 2,7-dibromo-4-methoxyfluoren-9-one.

Molecular Properties

Compound Name2,7-dibromo-4-methoxyfluoren-9-one
PubChem CID175173621
Molecular FormulaC14H8Br2O2
Molecular Weight368.02 g/mol
Exact Mass365.89
IUPAC Name2,7-dibromo-4-methoxyfluoren-9-one
SMILESCOc1cc(Br)cc2c1-c1ccc(Br)cc1C2=O
InChIInChI=1S/C14H8Br2O2/c1-18-12-6-8(16)5-11-13(12)9-3-2-7(15)4-10(9)14(11)17/h2-6H,1H3
InChIKeyYQBAOJQDQUZKFR-UHFFFAOYSA-N
XLogP4.43
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.02
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2,7-dibromo-4-methoxyfluoren-9-one?
The IUPAC name of 2,7-dibromo-4-methoxyfluoren-9-one (CID 175173621) is 2,7-dibromo-4-methoxyfluoren-9-one.
What is the SMILES notation for 2,7-dibromo-4-methoxyfluoren-9-one?
The canonical SMILES for 2,7-dibromo-4-methoxyfluoren-9-one is COc1cc(Br)cc2c1-c1ccc(Br)cc1C2=O.
What is the InChIKey of 2,7-dibromo-4-methoxyfluoren-9-one?
The InChIKey is YQBAOJQDQUZKFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Br2O2/c1-18-12-6-8(16)5-11-13(12)9-3-2-7(15)4-10(9)14(11)17/h2-6H,1H3.
What are the key properties of 2,7-dibromo-4-methoxyfluoren-9-one?
2,7-dibromo-4-methoxyfluoren-9-one has a molecular weight of 368.02 g/mol, XLogP of 4.43, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dibromo-4-methoxyfluoren-9-one is sourced from PubChem (CID 175173621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).