3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one

C9H8ClNO3 — CID 58394005

IUPAC3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1ccc(O)c(Cl)c1
InChIInChI=1S/C9H8ClNO3/c10-7-5-6(1-2-8(7)12)11-3-4-14-9(11)13/h1-2,5,12H,3-4H2
InChIKeyLRQVCHXIDSEBTC-UHFFFAOYSA-N
MW213.62 g/mol
LogP2.00
Rot. Bonds1

About 3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one

3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one (PubChem CID 58394005) has the molecular formula C9H8ClNO3 and a molecular weight of 213.62 g/mol. Its IUPAC name is 3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one
PubChem CID58394005
Molecular FormulaC9H8ClNO3
Molecular Weight213.62 g/mol
Exact Mass213.02
IUPAC Name3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1ccc(O)c(Cl)c1
InChIInChI=1S/C9H8ClNO3/c10-7-5-6(1-2-8(7)12)11-3-4-14-9(11)13/h1-2,5,12H,3-4H2
InChIKeyLRQVCHXIDSEBTC-UHFFFAOYSA-N
XLogP2.00
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.62
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-bromo-3-chlorophenyl)-1,3-oxazolidin-2-one
CID 107612952
3-(4-amino-3-hydroxyphenyl)-1,3-oxazolidin-2-one
CID 89289415
3-(2-chloroquinazolin-7-yl)-1,3-oxazolidin-2-one
CID 162747859
(1R,2R,6S,7S)-4-(3-chloro-4-hydroxyphenyl)-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
CID 68546488
3-(4-bromo-3-methylphenyl)-1,3-oxazolidin-2-one
CID 66817851
3-(3-bromo-4-fluorophenyl)-1,3-oxazolidin-2-one
CID 104779667
3-(2,6-dichlorophenyl)-1,3-oxazolidin-2-one
CID 14120198
3-(4-phenylphenyl)-1,3-oxazolidin-2-one
CID 102377598
3-(4-chlorophenyl)-1,3-oxazinan-2-one
CID 13450496
3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one
CID 23020757
3,4-dichloro-1-(3-chloro-4-hydroxyphenyl)pyrrole-2,5-dione
CID 139805892
3-(4-bromo-3-fluorophenyl)-1,3-oxazolidin-2-one;methanesulfonic acid
CID 158400380

Frequently Asked Questions

What is the IUPAC name of 3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one?
The IUPAC name of 3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one (CID 58394005) is 3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one is O=C1OCCN1c1ccc(O)c(Cl)c1.
What is the InChIKey of 3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one?
The InChIKey is LRQVCHXIDSEBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClNO3/c10-7-5-6(1-2-8(7)12)11-3-4-14-9(11)13/h1-2,5,12H,3-4H2.
What are the key properties of 3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one?
3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one has a molecular weight of 213.62 g/mol, XLogP of 2.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chloro-4-hydroxyphenyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 58394005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).