CID 5364901

C4H3O — CID 5364901

IUPAC—
SMILES[c]1ccco1
InChIInChI=1S/C4H3O/c1-2-4-5-3-1/h1-3H
InChIKeyFHTSIFHJYGMMMD-UHFFFAOYSA-N
MW67.07 g/mol
LogP1.08
Rot. Bonds

About CID 5364901

CID 5364901 (PubChem CID 5364901) has the molecular formula C4H3O and a molecular weight of 67.07 g/mol.

Molecular Properties

Compound NameCID 5364901
PubChem CID5364901
Molecular FormulaC4H3O
Molecular Weight67.07 g/mol
Exact Mass67.02
IUPAC Name—
SMILES[c]1ccco1
InChIInChI=1S/C4H3O/c1-2-4-5-3-1/h1-3H
InChIKeyFHTSIFHJYGMMMD-UHFFFAOYSA-N
XLogP1.08
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50067.07
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Furan
CID 8029
3-Methylfuran
CID 13587
3-Furaldehyde
CID 10351
2-Furylmercury chloride
CID 22131
2-Methoxyfuran
CID 117476
Furan-2-boronic acid
CID 2734357
3-Bromofuran
CID 89164
2-Furyltrimethylsilane
CID 137092
3-Vinylfuran
CID 181887
Furan, 2-bromo-
CID 2776190
2-Iodofuran
CID 11564629
Furan-d4
CID 2733420

Frequently Asked Questions

What is the IUPAC name of CID 5364901?
The IUPAC name of CID 5364901 (CID 5364901) is not available.
What is the SMILES notation for CID 5364901?
The canonical SMILES for CID 5364901 is [c]1ccco1.
What is the InChIKey of CID 5364901?
The InChIKey is FHTSIFHJYGMMMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3O/c1-2-4-5-3-1/h1-3H.
What are the key properties of CID 5364901?
CID 5364901 has a molecular weight of 67.07 g/mol, XLogP of 1.08, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 5364901 is sourced from PubChem (CID 5364901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).