Home Sulfos 1-[(3-Bromobenzene)sulfonyl]homopiperidine

1-[(3-Bromobenzene)sulfonyl]homopiperidine

CAS No.:
1022438-79-4
Catalog Number:
AG008URI
Molecular Formula:
C12H16BrNO2S
Molecular Weight:
318.2299
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$84
- +
5g
1 week
United States
$217
- +
Product Description
Catalog Number:
AG008URI
Chemical Name:
1-[(3-Bromobenzene)sulfonyl]homopiperidine
CAS Number:
1022438-79-4
Molecular Formula:
C12H16BrNO2S
Molecular Weight:
318.2299
MDL Number:
MFCD12650323
IUPAC Name:
1-(3-bromophenyl)sulfonylazepane
InChI:
InChI=1S/C12H16BrNO2S/c13-11-6-5-7-12(10-11)17(15,16)14-8-3-1-2-4-9-14/h5-7,10H,1-4,8-9H2
InChI Key:
XDMGKPLXTVIENO-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)S(=O)(=O)N1CCCCCC1
Properties
Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.009g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.229g/mol
Monoisotopic Mass:
317.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties