(4-acetyl-3-ethylphenyl) hypofluorite

C10H11FO2 — CID 153392017

IUPAC(4-acetyl-3-ethylphenyl) hypofluorite
SMILESCCc1cc(OF)ccc1C(C)=O
InChIInChI=1S/C10H11FO2/c1-3-8-6-9(13-11)4-5-10(8)7(2)12/h4-6H,3H2,1-2H3
InChIKeyCIMJGZBGTAJCGK-UHFFFAOYSA-N
MW182.19 g/mol
LogP2.71
Rot. Bonds3

About (4-acetyl-3-ethylphenyl) hypofluorite

(4-acetyl-3-ethylphenyl) hypofluorite (PubChem CID 153392017) has the molecular formula C10H11FO2 and a molecular weight of 182.19 g/mol. Its IUPAC name is (4-acetyl-3-ethylphenyl) hypofluorite.

Molecular Properties

Compound Name(4-acetyl-3-ethylphenyl) hypofluorite
PubChem CID153392017
Molecular FormulaC10H11FO2
Molecular Weight182.19 g/mol
Exact Mass182.07
IUPAC Name(4-acetyl-3-ethylphenyl) hypofluorite
SMILESCCc1cc(OF)ccc1C(C)=O
InChIInChI=1S/C10H11FO2/c1-3-8-6-9(13-11)4-5-10(8)7(2)12/h4-6H,3H2,1-2H3
InChIKeyCIMJGZBGTAJCGK-UHFFFAOYSA-N
XLogP2.71
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.19
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-[(4-bromophenyl)methoxy]-2-ethylphenyl]ethanone
CID 91864406
1-[4-[(2-bromophenyl)methoxy]-2-ethylphenyl]ethanone
CID 91864376
1-(2-butyl-4-methoxyphenyl)ethanone
CID 67001427
1-[2-ethyl-4-[[4-[(E)-2-hydroxyethenyl]phenyl]methoxy]phenyl]ethanone
CID 155703815
methyl 4-[(4-acetyl-3-ethylphenoxy)methyl]benzoate
CID 91864413
2-(2-acetyl-5-ethoxyphenyl)acetaldehyde
CID 53375331
methyl 2-(2-acetyl-5-methoxyphenyl)acetate
CID 10632802
propan-2-yl 2-ethyl-4-propan-2-yloxybenzoate
CID 82552007
2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene
CID 70232732
2-ethyl-4-methoxybenzoate
CID 23362607
2-ethyl-4-(trifluoromethoxy)benzamide
CID 141054178
1-[4-[(2-ethylphenyl)methoxy]-2-fluorophenyl]ethanone
CID 91863374

Frequently Asked Questions

What is the IUPAC name of (4-acetyl-3-ethylphenyl) hypofluorite?
The IUPAC name of (4-acetyl-3-ethylphenyl) hypofluorite (CID 153392017) is (4-acetyl-3-ethylphenyl) hypofluorite.
What is the SMILES notation for (4-acetyl-3-ethylphenyl) hypofluorite?
The canonical SMILES for (4-acetyl-3-ethylphenyl) hypofluorite is CCc1cc(OF)ccc1C(C)=O.
What is the InChIKey of (4-acetyl-3-ethylphenyl) hypofluorite?
The InChIKey is CIMJGZBGTAJCGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO2/c1-3-8-6-9(13-11)4-5-10(8)7(2)12/h4-6H,3H2,1-2H3.
What are the key properties of (4-acetyl-3-ethylphenyl) hypofluorite?
(4-acetyl-3-ethylphenyl) hypofluorite has a molecular weight of 182.19 g/mol, XLogP of 2.71, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-acetyl-3-ethylphenyl) hypofluorite is sourced from PubChem (CID 153392017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).