(7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate

C24H24O2 — CID 134170344

IUPAC(7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate
SMILESCCC1(OC(=O)C(C)(C)C)c2ccccc2-c2c1ccc1ccccc21
InChIInChI=1S/C24H24O2/c1-5-24(26-22(25)23(2,3)4)19-13-9-8-12-18(19)21-17-11-7-6-10-16(17)14-15-20(21)24/h6-15H,5H2,1-4H3
InChIKeyWPZNXPISAOUMPA-UHFFFAOYSA-N
MW344.45 g/mol
LogP6.06
Rot. Bonds2

About (7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate

(7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate (PubChem CID 134170344) has the molecular formula C24H24O2 and a molecular weight of 344.45 g/mol. Its IUPAC name is (7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate.

Molecular Properties

Compound Name(7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate
PubChem CID134170344
Molecular FormulaC24H24O2
Molecular Weight344.45 g/mol
Exact Mass344.18
IUPAC Name(7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate
SMILESCCC1(OC(=O)C(C)(C)C)c2ccccc2-c2c1ccc1ccccc21
InChIInChI=1S/C24H24O2/c1-5-24(26-22(25)23(2,3)4)19-13-9-8-12-18(19)21-17-11-7-6-10-16(17)14-15-20(21)24/h6-15H,5H2,1-4H3
InChIKeyWPZNXPISAOUMPA-UHFFFAOYSA-N
XLogP6.06
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.45
LogP ≤ 56.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(7-methylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate
CID 134170383
[4-[11-(2,2-dimethylpropanoyloxy)-11-ethenylbenzo[a]fluoren-8-yl]-7-ethenylbenzo[c]fluoren-7-yl] 2,2-dimethylpropanoate
CID 130411241
(7-propan-2-ylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate
CID 59476831
7,7-dimethylbenzo[c]fluorene;hydroiodide
CID 144938625
7,7-dimethylbenzo[c]fluorene;ethane
CID 90712910
4'-methylspiro[benzo[c]fluorene-7,9'-fluorene]
CID 140792308
1'-methylspiro[benzo[c]fluorene-7,9'-fluorene]
CID 153412677
7-prop-1-ynylbenzo[c]fluoren-7-ol
CID 164808851
CID 142592951
CID 142592951
7,7-dioctylbenzo[c]fluorene
CID 59595496
spiro[benzo[c]fluorene-7,1'-cyclopentane]
CID 59806731
(9-prop-2-ynylthioxanthen-9-yl) 2,2-dimethylpropanoate
CID 129105731

Frequently Asked Questions

What is the IUPAC name of (7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate?
The IUPAC name of (7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate (CID 134170344) is (7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate.
What is the SMILES notation for (7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate?
The canonical SMILES for (7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate is CCC1(OC(=O)C(C)(C)C)c2ccccc2-c2c1ccc1ccccc21.
What is the InChIKey of (7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate?
The InChIKey is WPZNXPISAOUMPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24O2/c1-5-24(26-22(25)23(2,3)4)19-13-9-8-12-18(19)21-17-11-7-6-10-16(17)14-15-20(21)24/h6-15H,5H2,1-4H3.
What are the key properties of (7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate?
(7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate has a molecular weight of 344.45 g/mol, XLogP of 6.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7-ethylbenzo[c]fluoren-7-yl) 2,2-dimethylpropanoate is sourced from PubChem (CID 134170344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).