HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

Methyl 9-methylfluorene-9-carboxylate

HCID 14934655
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)C1(C)c2ccccc2-c2ccccc21
InChIKey
IHPSWTZHVWAGFX-UHFFFAOYSA-N
Molecular formula
C16H14O2
Average molar mass
238.28 g/mol

Names & identifiers

Preferred name
Methyl 9-methylfluorene-9-carboxylate
IUPAC
methyl 9-methylfluorene-9-carboxylate

Names & synonyms

methyl 9-methylfluorene-9-carboxylate3300-16-1Methyl 9-methyl-9H-fluorene-9-carboxylateSCHEMBL4217613IHPSWTZHVWAGFX-UHFFFAOYSA-Nmethyl9-methylfluorene-9-carboxylateMFCD00577363BS-34039DB-086767

Database identifiers

PubChem CID
14934655

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
314

Related reactions

7 records
New reaction record
HRID 33416 reaction equation
HRID 33416As productuspto-grants-2008_09
HRID 33417 reaction equation
HRID 33417As reactantuspto-grants-2008_09
HRID 890604 reaction equation
HRID 890604As reactantuspto-grants-2006_02
HRID 1006429 reaction equation
HRID 1006429As productuspto-grants-2004_09
HRID 1350548 reaction equation
HRID 1350548As reactantuspto-grants-2007_05
HRID 2160990 reaction equation
HRID 2160990As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID 2414772 reaction equation
HRID 2414772As productuspto-grants-2004_11

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes