9-deuterio-9-methylfluorene

C14H12 — CID 169301704

IUPAC9-deuterio-9-methylfluorene
SMILES[2H]C1(C)c2ccccc2-c2ccccc21
InChIInChI=1S/C14H12/c1-10-11-6-2-4-8-13(11)14-9-5-3-7-12(10)14/h2-10H,1H3/i10D
InChIKeyZVEJRZRAUYJYCO-MMIHMFRQSA-N
MW181.26 g/mol
LogP3.82
Rot. Bonds

About 9-deuterio-9-methylfluorene

9-deuterio-9-methylfluorene (PubChem CID 169301704) has the molecular formula C14H12 and a molecular weight of 181.26 g/mol. Its IUPAC name is 9-deuterio-9-methylfluorene.

Molecular Properties

Compound Name9-deuterio-9-methylfluorene
PubChem CID169301704
Molecular FormulaC14H12
Molecular Weight181.26 g/mol
Exact Mass181.10
IUPAC Name9-deuterio-9-methylfluorene
SMILES[2H]C1(C)c2ccccc2-c2ccccc21
InChIInChI=1S/C14H12/c1-10-11-6-2-4-8-13(11)14-9-5-3-7-12(10)14/h2-10H,1H3/i10D
InChIKeyZVEJRZRAUYJYCO-MMIHMFRQSA-N
XLogP3.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.26
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

9-deuterio-9-deuteriooxyfluorene
CID 134981365
9-methyl-9H-fluorene;prop-1-ene
CID 145012304
1,3-dimethyl-1H-indene;ethane
CID 90859449
lithium 9-ethyl-9H-fluorene
CID 23225742
9-[2-(9H-fluoren-9-yl)propan-2-yl]-9H-fluorene
CID 22619280
9-fluoro-9H-fluorene
CID 12685099
(9S,18S,27S)-9,18,27-trimethylheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene
CID 101264087
7,8-dimethylbicyclo[4.2.0]octa-1,3,5-triene;ethane
CID 159809006
8,9,16,17-tetrabromotetracyclo[16.4.0.02,7.010,15]docosa-1(22),2,4,6,10,12,14,18,20-nonaene
CID 11135759
1,9-dimethyl-9H-fluorene
CID 28227
chloro-(9H-fluoren-9-yl)-methylsilane
CID 91867940
6-deuterio-5-methyl-6-phenylphenanthridine
CID 59051862

Frequently Asked Questions

What is the IUPAC name of 9-deuterio-9-methylfluorene?
The IUPAC name of 9-deuterio-9-methylfluorene (CID 169301704) is 9-deuterio-9-methylfluorene.
What is the SMILES notation for 9-deuterio-9-methylfluorene?
The canonical SMILES for 9-deuterio-9-methylfluorene is [2H]C1(C)c2ccccc2-c2ccccc21.
What is the InChIKey of 9-deuterio-9-methylfluorene?
The InChIKey is ZVEJRZRAUYJYCO-MMIHMFRQSA-N. The full InChI is InChI=1S/C14H12/c1-10-11-6-2-4-8-13(11)14-9-5-3-7-12(10)14/h2-10H,1H3/i10D.
What are the key properties of 9-deuterio-9-methylfluorene?
9-deuterio-9-methylfluorene has a molecular weight of 181.26 g/mol, XLogP of 3.82, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-deuterio-9-methylfluorene is sourced from PubChem (CID 169301704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).