9H-fluoren-3-ylmethyl formate

C15H12O2 — CID 19917781

IUPAC9H-fluoren-3-ylmethyl formate
SMILESO=COCc1ccc2c(c1)-c1ccccc1C2
InChIInChI=1S/C15H12O2/c16-10-17-9-11-5-6-13-8-12-3-1-2-4-14(12)15(13)7-11/h1-7,10H,8-9H2
InChIKeyLEUWPMITPCZFQV-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.93
Rot. Bonds3

About 9H-fluoren-3-ylmethyl formate

9H-fluoren-3-ylmethyl formate (PubChem CID 19917781) has the molecular formula C15H12O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 9H-fluoren-3-ylmethyl formate.

Molecular Properties

Compound Name9H-fluoren-3-ylmethyl formate
PubChem CID19917781
Molecular FormulaC15H12O2
Molecular Weight224.26 g/mol
Exact Mass224.08
IUPAC Name9H-fluoren-3-ylmethyl formate
SMILESO=COCc1ccc2c(c1)-c1ccccc1C2
InChIInChI=1S/C15H12O2/c16-10-17-9-11-5-6-13-8-12-3-1-2-4-14(12)15(13)7-11/h1-7,10H,8-9H2
InChIKeyLEUWPMITPCZFQV-UHFFFAOYSA-N
XLogP2.93
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-3-ylmethyl formate?
The IUPAC name of 9H-fluoren-3-ylmethyl formate (CID 19917781) is 9H-fluoren-3-ylmethyl formate.
What is the SMILES notation for 9H-fluoren-3-ylmethyl formate?
The canonical SMILES for 9H-fluoren-3-ylmethyl formate is O=COCc1ccc2c(c1)-c1ccccc1C2.
What is the InChIKey of 9H-fluoren-3-ylmethyl formate?
The InChIKey is LEUWPMITPCZFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12O2/c16-10-17-9-11-5-6-13-8-12-3-1-2-4-14(12)15(13)7-11/h1-7,10H,8-9H2.
What are the key properties of 9H-fluoren-3-ylmethyl formate?
9H-fluoren-3-ylmethyl formate has a molecular weight of 224.26 g/mol, XLogP of 2.93, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-3-ylmethyl formate is sourced from PubChem (CID 19917781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).