cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate

C23H26O3 — CID 90407711

IUPACcyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate
SMILESCOCC1(C(=O)OCC2CCCCC2)c2ccccc2-c2ccccc21
InChIInChI=1S/C23H26O3/c1-25-16-23(22(24)26-15-17-9-3-2-4-10-17)20-13-7-5-11-18(20)19-12-6-8-14-21(19)23/h5-8,11-14,17H,2-4,9-10,15-16H2,1H3
InChIKeyRUQYBHQPJXUNQF-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.72
Rot. Bonds5

About cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate

cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate (PubChem CID 90407711) has the molecular formula C23H26O3 and a molecular weight of 350.46 g/mol. Its IUPAC name is cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate.

Molecular Properties

Compound Namecyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate
PubChem CID90407711
Molecular FormulaC23H26O3
Molecular Weight350.46 g/mol
Exact Mass350.19
IUPAC Namecyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate
SMILESCOCC1(C(=O)OCC2CCCCC2)c2ccccc2-c2ccccc21
InChIInChI=1S/C23H26O3/c1-25-16-23(22(24)26-15-17-9-3-2-4-10-17)20-13-7-5-11-18(20)19-12-6-8-14-21(19)23/h5-8,11-14,17H,2-4,9-10,15-16H2,1H3
InChIKeyRUQYBHQPJXUNQF-UHFFFAOYSA-N
XLogP4.72
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-methyloctyl 9-(methoxymethyl)fluorene-9-carboxylate
CID 90407620
13-methyltetradecyl 9-(methoxymethyl)fluorene-9-carboxylate
CID 90407730
methyl (2S)-3-cyclohexyl-2-[(9-phenylfluoren-9-yl)amino]propanoate
CID 10788530
2-ethyltridecyl 9-(methoxymethyl)fluorene-9-carboxylate
CID 90408527
benzoic acid;methoxymethylcyclohexane
CID 175415905
1-[9-(methoxymethyl)fluoren-9-yl]pentan-1-one
CID 67497909
methyl 9-(ethoxymethyl)fluorene-9-carboxylate
CID 90407926
9H-fluoren-9-ylmethyl 3-hydroxy-3-(methoxymethyl)azetidine-1-carboxylate
CID 130962442
cyclohexylmethyl (2S)-2-phenylpropanoate
CID 134967383
1-(9H-fluoren-9-ylmethoxycarbonyl)-3-(methoxymethyl)azetidine-3-carboxylic acid
CID 139026343
cyclohexylmethyl pyrrolidine-1-carboxylate
CID 85230627
cyclohexylmethyl (3aS)-4-ethyl-1,5-dioxo-2,3-dihydropyrrolo[1,2-a]quinazoline-3a-carboxylate
CID 8510320

Frequently Asked Questions

What is the IUPAC name of cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate?
The IUPAC name of cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate (CID 90407711) is cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate.
What is the SMILES notation for cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate?
The canonical SMILES for cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate is COCC1(C(=O)OCC2CCCCC2)c2ccccc2-c2ccccc21.
What is the InChIKey of cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate?
The InChIKey is RUQYBHQPJXUNQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26O3/c1-25-16-23(22(24)26-15-17-9-3-2-4-10-17)20-13-7-5-11-18(20)19-12-6-8-14-21(19)23/h5-8,11-14,17H,2-4,9-10,15-16H2,1H3.
What are the key properties of cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate?
cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate has a molecular weight of 350.46 g/mol, XLogP of 4.72, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethyl 9-(methoxymethyl)fluorene-9-carboxylate is sourced from PubChem (CID 90407711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).