N-(3-Bromophenyl)-1,3-propanesultam - CAS 71703-15-6
Catalog: |
BB071272 |
Product Name: |
N-(3-Bromophenyl)-1,3-propanesultam |
CAS: |
71703-15-6 |
Synonyms: |
2-(3-Bromophenyl)isothiazolidine 1,1-dioxide; N-(3-Bromophenyl)-1,3-propanesultam; 2-(3-bromophenyl)-1,2-thiazolidine 1,1-dioxide; 2-(3-Bromophenyl)isothiazolidine1,1-dioxide |
IUPAC Name: | 2-(3-bromophenyl)-1,2-thiazolidine 1,1-dioxide |
Description: | N-(3-Bromophenyl)-1,3-propanesultam |
Molecular Weight: | 276.15 |
Molecular Formula: | C9H10BrNO2S |
Canonical SMILES: | C1CN(S(=O)(=O)C1)C2=CC(=CC=C2)Br |
InChI: | InChI=1S/C9H10BrNO2S/c10-8-3-1-4-9(7-8)11-5-2-6-14(11,12)13/h1,3-4,7H,2,5-6H2 |
InChI Key: | PDZFOXCQQCMSHZ-UHFFFAOYSA-N |
Complexity: | 298 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 274.96156 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 274.96156 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 45.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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