9-methyl-9H-fluorene;prop-1-ene

C17H18 — CID 145012304

IUPAC9-methyl-9H-fluorene;prop-1-ene
SMILESC=CC.CC1c2ccccc2-c2ccccc21
InChIInChI=1S/C14H12.C3H6/c1-10-11-6-2-4-8-13(11)14-9-5-3-7-12(10)14;1-3-2/h2-10H,1H3;3H,1H2,2H3
InChIKeyIWOUKYLDYHCTHG-UHFFFAOYSA-N
MW222.33 g/mol
LogP5.01
Rot. Bonds

About 9-methyl-9H-fluorene;prop-1-ene

9-methyl-9H-fluorene;prop-1-ene (PubChem CID 145012304) has the molecular formula C17H18 and a molecular weight of 222.33 g/mol. Its IUPAC name is 9-methyl-9H-fluorene;prop-1-ene.

Molecular Properties

Compound Name9-methyl-9H-fluorene;prop-1-ene
PubChem CID145012304
Molecular FormulaC17H18
Molecular Weight222.33 g/mol
Exact Mass222.14
IUPAC Name9-methyl-9H-fluorene;prop-1-ene
SMILESC=CC.CC1c2ccccc2-c2ccccc21
InChIInChI=1S/C14H12.C3H6/c1-10-11-6-2-4-8-13(11)14-9-5-3-7-12(10)14;1-3-2/h2-10H,1H3;3H,1H2,2H3
InChIKeyIWOUKYLDYHCTHG-UHFFFAOYSA-N
XLogP5.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500222.33
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-9H-fluorene;prop-1-ene?
The IUPAC name of 9-methyl-9H-fluorene;prop-1-ene (CID 145012304) is 9-methyl-9H-fluorene;prop-1-ene.
What is the SMILES notation for 9-methyl-9H-fluorene;prop-1-ene?
The canonical SMILES for 9-methyl-9H-fluorene;prop-1-ene is C=CC.CC1c2ccccc2-c2ccccc21.
What is the InChIKey of 9-methyl-9H-fluorene;prop-1-ene?
The InChIKey is IWOUKYLDYHCTHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12.C3H6/c1-10-11-6-2-4-8-13(11)14-9-5-3-7-12(10)14;1-3-2/h2-10H,1H3;3H,1H2,2H3.
What are the key properties of 9-methyl-9H-fluorene;prop-1-ene?
9-methyl-9H-fluorene;prop-1-ene has a molecular weight of 222.33 g/mol, XLogP of 5.01, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-9H-fluorene;prop-1-ene is sourced from PubChem (CID 145012304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).