chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one

C7H9Cl4N2O5P — CID 158854803

IUPACchloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one
SMILESClC(Cl)Cl.O=C1OCCN1P(=O)(Cl)N1CCOC1=O
InChIInChI=1S/C6H8ClN2O5P.CHCl3/c7-15(12,8-1-3-13-5(8)10)9-2-4-14-6(9)11;2-1(3)4/h1-4H2;1H
InChIKeyIZXHIQLHTLALMA-UHFFFAOYSA-N
MW373.94 g/mol
LogP3.22
Rot. Bonds2

About chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one

chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one (PubChem CID 158854803) has the molecular formula C7H9Cl4N2O5P and a molecular weight of 373.94 g/mol. Its IUPAC name is chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Namechloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one
PubChem CID158854803
Molecular FormulaC7H9Cl4N2O5P
Molecular Weight373.94 g/mol
Exact Mass371.90
IUPAC Namechloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one
SMILESClC(Cl)Cl.O=C1OCCN1P(=O)(Cl)N1CCOC1=O
InChIInChI=1S/C6H8ClN2O5P.CHCl3/c7-15(12,8-1-3-13-5(8)10)9-2-4-14-6(9)11;2-1(3)4/h1-4H2;1H
InChIKeyIZXHIQLHTLALMA-UHFFFAOYSA-N
XLogP3.22
TPSA76.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.94
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one?
The IUPAC name of chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one (CID 158854803) is chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one.
What is the SMILES notation for chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one?
The canonical SMILES for chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one is ClC(Cl)Cl.O=C1OCCN1P(=O)(Cl)N1CCOC1=O.
What is the InChIKey of chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one?
The InChIKey is IZXHIQLHTLALMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClN2O5P.CHCl3/c7-15(12,8-1-3-13-5(8)10)9-2-4-14-6(9)11;2-1(3)4/h1-4H2;1H.
What are the key properties of chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one?
chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one has a molecular weight of 373.94 g/mol, XLogP of 3.22, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for chloroform;3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 158854803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).