CID 58361867

C8H7FO — CID 58361867

IUPAC—
SMILES[CH]c1cc(F)cc(OC)c1
InChIInChI=1S/C8H7FO/c1-6-3-7(9)5-8(4-6)10-2/h1,3-5H,2H3
InChIKeyITPFIFNAGDUOJP-UHFFFAOYSA-N
MW138.14 g/mol
LogP1.89
Rot. Bonds1

About CID 58361867

CID 58361867 (PubChem CID 58361867) has the molecular formula C8H7FO and a molecular weight of 138.14 g/mol.

Molecular Properties

Compound NameCID 58361867
PubChem CID58361867
Molecular FormulaC8H7FO
Molecular Weight138.14 g/mol
Exact Mass138.05
IUPAC Name—
SMILES[CH]c1cc(F)cc(OC)c1
InChIInChI=1S/C8H7FO/c1-6-3-7(9)5-8(4-6)10-2/h1,3-5H,2H3
InChIKeyITPFIFNAGDUOJP-UHFFFAOYSA-N
XLogP1.89
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.14
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(3-fluoro-5-methoxyphenyl)methanol
CID 26985456
2,2-difluoro-1-(3-fluoro-5-methoxyphenyl)ethanone
CID 126972003
1-fluoro-3-methoxy-5-(4-methylsulfanylphenyl)benzene
CID 70699755
(3-fluoro-5-methoxyphenyl)hydrazine;hydrochloride
CID 71756043
1,3-bis(4-fluorophenyl)-5-methoxybenzene
CID 137385203
1,2,3-trifluoro-4-(3-fluoro-5-methoxyphenyl)benzene
CID 165487058
3-(3-fluoro-5-methoxyphenyl)-1H-pyrrole
CID 174803802
1,2-difluoro-3-(3-fluoro-5-methoxyphenyl)benzene
CID 134627065
3-(3-fluoro-5-methoxyphenyl)cyclopent-2-en-1-one
CID 131166122
[4-(3-fluoro-5-methoxyphenyl)phenyl]methanol
CID 170385205
1-(3,5-dimethoxyphenoxy)-3-fluoro-5-nitrobenzene
CID 80752219
phosphane;1,3,5-trimethoxybenzene
CID 175232895

Frequently Asked Questions

What is the IUPAC name of CID 58361867?
The IUPAC name of CID 58361867 (CID 58361867) is not available.
What is the SMILES notation for CID 58361867?
The canonical SMILES for CID 58361867 is [CH]c1cc(F)cc(OC)c1.
What is the InChIKey of CID 58361867?
The InChIKey is ITPFIFNAGDUOJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FO/c1-6-3-7(9)5-8(4-6)10-2/h1,3-5H,2H3.
What are the key properties of CID 58361867?
CID 58361867 has a molecular weight of 138.14 g/mol, XLogP of 1.89, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58361867 is sourced from PubChem (CID 58361867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).