2-(9H-fluoren-9-yl)ethyl acetate

C17H16O2 — CID 134437630

IUPAC2-(9H-fluoren-9-yl)ethyl acetate
SMILESCC(=O)OCCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C17H16O2/c1-12(18)19-11-10-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,17H,10-11H2,1H3
InChIKeyGSTBRQWQGDNFEX-UHFFFAOYSA-N
MW252.31 g/mol
LogP3.75
Rot. Bonds3

About 2-(9H-fluoren-9-yl)ethyl acetate

2-(9H-fluoren-9-yl)ethyl acetate (PubChem CID 134437630) has the molecular formula C17H16O2 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2-(9H-fluoren-9-yl)ethyl acetate.

Molecular Properties

Compound Name2-(9H-fluoren-9-yl)ethyl acetate
PubChem CID134437630
Molecular FormulaC17H16O2
Molecular Weight252.31 g/mol
Exact Mass252.12
IUPAC Name2-(9H-fluoren-9-yl)ethyl acetate
SMILESCC(=O)OCCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C17H16O2/c1-12(18)19-11-10-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,17H,10-11H2,1H3
InChIKeyGSTBRQWQGDNFEX-UHFFFAOYSA-N
XLogP3.75
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(9H-fluoren-9-yl)ethoxymethanethioic S-acid
CID 87914103
2-(9H-fluoren-9-yl)ethyl N-(2-hydroxyethyl)carbamate
CID 141394718
ethane;4-(9H-fluoren-9-yl)butan-2-one
CID 143985685
9H-fluoren-9-ylmethyl 2-(2-acetyloxyethyl)piperidine-1-carboxylate
CID 72747808
2-(2,3-dihydro-1-benzofuran-3-yl)ethyl acetate
CID 15732877
9H-fluoren-9-ylmethyl N-[(E)-1-hydroxyprop-1-en-2-yl]carbamate
CID 138478780
9H-fluoren-9-ylmethyl carbonofluoridate
CID 10131014
9H-fluoren-9-ylmethyl 2-bromoacetate
CID 86059891
9H-fluoren-9-ylmethyl carbamate;hydrochloride
CID 66959107
(9-acetyl-9H-fluoren-3-yl)methyl acetate
CID 143174369
acetic acid;9H-fluoren-9-ylmethyl 4-aminocyclohexane-1-carboxylate
CID 53444085
butyl 9H-fluoren-9-ylmethyl carbonate
CID 114289496

Frequently Asked Questions

What is the IUPAC name of 2-(9H-fluoren-9-yl)ethyl acetate?
The IUPAC name of 2-(9H-fluoren-9-yl)ethyl acetate (CID 134437630) is 2-(9H-fluoren-9-yl)ethyl acetate.
What is the SMILES notation for 2-(9H-fluoren-9-yl)ethyl acetate?
The canonical SMILES for 2-(9H-fluoren-9-yl)ethyl acetate is CC(=O)OCCC1c2ccccc2-c2ccccc21.
What is the InChIKey of 2-(9H-fluoren-9-yl)ethyl acetate?
The InChIKey is GSTBRQWQGDNFEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O2/c1-12(18)19-11-10-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,17H,10-11H2,1H3.
What are the key properties of 2-(9H-fluoren-9-yl)ethyl acetate?
2-(9H-fluoren-9-yl)ethyl acetate has a molecular weight of 252.31 g/mol, XLogP of 3.75, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9H-fluoren-9-yl)ethyl acetate is sourced from PubChem (CID 134437630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).