4-(2-bromo-4-chlorophenyl)sulfonylmorpholine

C10H11BrClNO3S — CID 772154

IUPAC4-(2-bromo-4-chlorophenyl)sulfonylmorpholine
SMILESO=S(=O)(c1ccc(Cl)cc1Br)N1CCOCC1
InChIInChI=1S/C10H11BrClNO3S/c11-9-7-8(12)1-2-10(9)17(14,15)13-3-5-16-6-4-13/h1-2,7H,3-6H2
InChIKeyGXJHOPOPQAQIAP-UHFFFAOYSA-N
MW340.63 g/mol
LogP2.12
Rot. Bonds2

About 4-(2-bromo-4-chlorophenyl)sulfonylmorpholine

4-(2-bromo-4-chlorophenyl)sulfonylmorpholine (PubChem CID 772154) has the molecular formula C10H11BrClNO3S and a molecular weight of 340.63 g/mol. Its IUPAC name is 4-(2-bromo-4-chlorophenyl)sulfonylmorpholine.

Molecular Properties

Compound Name4-(2-bromo-4-chlorophenyl)sulfonylmorpholine
PubChem CID772154
Molecular FormulaC10H11BrClNO3S
Molecular Weight340.63 g/mol
Exact Mass338.93
IUPAC Name4-(2-bromo-4-chlorophenyl)sulfonylmorpholine
SMILESO=S(=O)(c1ccc(Cl)cc1Br)N1CCOCC1
InChIInChI=1S/C10H11BrClNO3S/c11-9-7-8(12)1-2-10(9)17(14,15)13-3-5-16-6-4-13/h1-2,7H,3-6H2
InChIKeyGXJHOPOPQAQIAP-UHFFFAOYSA-N
XLogP2.12
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.63
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-bromo-4-chlorophenyl)sulfonylmorpholine?
The IUPAC name of 4-(2-bromo-4-chlorophenyl)sulfonylmorpholine (CID 772154) is 4-(2-bromo-4-chlorophenyl)sulfonylmorpholine.
What is the SMILES notation for 4-(2-bromo-4-chlorophenyl)sulfonylmorpholine?
The canonical SMILES for 4-(2-bromo-4-chlorophenyl)sulfonylmorpholine is O=S(=O)(c1ccc(Cl)cc1Br)N1CCOCC1.
What is the InChIKey of 4-(2-bromo-4-chlorophenyl)sulfonylmorpholine?
The InChIKey is GXJHOPOPQAQIAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrClNO3S/c11-9-7-8(12)1-2-10(9)17(14,15)13-3-5-16-6-4-13/h1-2,7H,3-6H2.
What are the key properties of 4-(2-bromo-4-chlorophenyl)sulfonylmorpholine?
4-(2-bromo-4-chlorophenyl)sulfonylmorpholine has a molecular weight of 340.63 g/mol, XLogP of 2.12, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-bromo-4-chlorophenyl)sulfonylmorpholine is sourced from PubChem (CID 772154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).