3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one

C6H8ClN2O4P — CID 11195784

IUPAC3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1P(Cl)N1CCOC1=O
InChIInChI=1S/C6H8ClN2O4P/c7-14(8-1-3-12-5(8)10)9-2-4-13-6(9)11/h1-4H2
InChIKeyGCBRVPBDJXYORQ-UHFFFAOYSA-N
MW238.57 g/mol
LogP1.36
Rot. Bonds2

About 3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one

3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one (PubChem CID 11195784) has the molecular formula C6H8ClN2O4P and a molecular weight of 238.57 g/mol. Its IUPAC name is 3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one
PubChem CID11195784
Molecular FormulaC6H8ClN2O4P
Molecular Weight238.57 g/mol
Exact Mass237.99
IUPAC Name3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1P(Cl)N1CCOC1=O
InChIInChI=1S/C6H8ClN2O4P/c7-14(8-1-3-12-5(8)10)9-2-4-13-6(9)11/h1-4H2
InChIKeyGCBRVPBDJXYORQ-UHFFFAOYSA-N
XLogP1.36
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.57
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Launch Full Analysis

Related Compounds

CID 88533496
CID 88533496
oxo-bis(2-oxo-1,3-oxazolidin-3-yl)phosphanium
CID 10987777
3-(azepan-1-yl)-1,3-oxazolidin-2-one
CID 130355886
chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one
CID 158854803
3-methylphosphanyloxy-1,3-oxazolidin-2-one
CID 59951361
3-(aminomethyl)-1,3-oxazolidin-2-one;hydrochloride
CID 141105157
2-oxo-1,3-oxazolidine-3-sulfonyl fluoride
CID 130225489
3-(2-bromoethyl)-1,3-oxazolidin-2-one
CID 22757234
3-(2-aminopropan-2-yl)-1,3-oxazolidin-2-one
CID 145080919
2-oxo-1,3-oxazolidine-3-sulfonic acid;hydrochloride
CID 174886365
3-(2-iodoethyl)-1,3-oxazolidin-2-one
CID 575068
3-(2,6-dichlorophenyl)-1,3-oxazolidin-2-one
CID 14120198

Frequently Asked Questions

What is the IUPAC name of 3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one (CID 11195784) is 3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one is O=C1OCCN1P(Cl)N1CCOC1=O.
What is the InChIKey of 3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one?
The InChIKey is GCBRVPBDJXYORQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClN2O4P/c7-14(8-1-3-12-5(8)10)9-2-4-13-6(9)11/h1-4H2.
What are the key properties of 3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one?
3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one has a molecular weight of 238.57 g/mol, XLogP of 1.36, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphanyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 11195784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).