2-(2,7-dichloro-9H-fluoren-4-yl)oxirane

C15H10Cl2O — CID 46911991

IUPAC2-(2,7-dichloro-9H-fluoren-4-yl)oxirane
SMILESClc1ccc2c(c1)Cc1cc(Cl)cc(C3CO3)c1-2
InChIInChI=1S/C15H10Cl2O/c16-10-1-2-12-8(4-10)3-9-5-11(17)6-13(15(9)12)14-7-18-14/h1-2,4-6,14H,3,7H2
InChIKeyGVFBXSRAIWZONX-UHFFFAOYSA-N
MW277.15 g/mol
LogP4.64
Rot. Bonds1

About 2-(2,7-dichloro-9H-fluoren-4-yl)oxirane

2-(2,7-dichloro-9H-fluoren-4-yl)oxirane (PubChem CID 46911991) has the molecular formula C15H10Cl2O and a molecular weight of 277.15 g/mol. Its IUPAC name is 2-(2,7-dichloro-9H-fluoren-4-yl)oxirane.

Molecular Properties

Compound Name2-(2,7-dichloro-9H-fluoren-4-yl)oxirane
PubChem CID46911991
Molecular FormulaC15H10Cl2O
Molecular Weight277.15 g/mol
Exact Mass276.01
IUPAC Name2-(2,7-dichloro-9H-fluoren-4-yl)oxirane
SMILESClc1ccc2c(c1)Cc1cc(Cl)cc(C3CO3)c1-2
InChIInChI=1S/C15H10Cl2O/c16-10-1-2-12-8(4-10)3-9-5-11(17)6-13(15(9)12)14-7-18-14/h1-2,4-6,14H,3,7H2
InChIKeyGVFBXSRAIWZONX-UHFFFAOYSA-N
XLogP4.64
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.15
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2,7-dichloro-9H-fluoren-4-yl)oxirane?
The IUPAC name of 2-(2,7-dichloro-9H-fluoren-4-yl)oxirane (CID 46911991) is 2-(2,7-dichloro-9H-fluoren-4-yl)oxirane.
What is the SMILES notation for 2-(2,7-dichloro-9H-fluoren-4-yl)oxirane?
The canonical SMILES for 2-(2,7-dichloro-9H-fluoren-4-yl)oxirane is Clc1ccc2c(c1)Cc1cc(Cl)cc(C3CO3)c1-2.
What is the InChIKey of 2-(2,7-dichloro-9H-fluoren-4-yl)oxirane?
The InChIKey is GVFBXSRAIWZONX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2O/c16-10-1-2-12-8(4-10)3-9-5-11(17)6-13(15(9)12)14-7-18-14/h1-2,4-6,14H,3,7H2.
What are the key properties of 2-(2,7-dichloro-9H-fluoren-4-yl)oxirane?
2-(2,7-dichloro-9H-fluoren-4-yl)oxirane has a molecular weight of 277.15 g/mol, XLogP of 4.64, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,7-dichloro-9H-fluoren-4-yl)oxirane is sourced from PubChem (CID 46911991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).