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Home Sulfos 1-[(4-Bromobenzene)sulfonyl]-4-methylhomopiperazine

1-[(4-Bromobenzene)sulfonyl]-4-methylhomopiperazine

CAS No.:
486422-31-5
Catalog Number:
AG00DC5H
Molecular Formula:
C12H17BrN2O2S
Molecular Weight:
333.2446
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$188
- +
5g
95%
In Stock USA
United States
$563
- +
10g
95%
In Stock USA
United States
$938
- +
25g
95%
In Stock USA
United States
$1875
- +
Product Description
Catalog Number:
AG00DC5H
Chemical Name:
1-[(4-Bromobenzene)sulfonyl]-4-methylhomopiperazine
CAS Number:
486422-31-5
Molecular Formula:
C12H17BrN2O2S
Molecular Weight:
333.2446
MDL Number:
MFCD12515248
IUPAC Name:
1-(4-bromophenyl)sulfonyl-4-methyl-1,4-diazepane
InChI:
InChI=1S/C12H17BrN2O2S/c1-14-7-2-8-15(10-9-14)18(16,17)12-5-3-11(13)4-6-12/h3-6H,2,7-10H2,1H3
InChI Key:
QCAXTVFTVHQJJQ-UHFFFAOYSA-N
SMILES:
CN1CCCN(CC1)S(=O)(=O)c1ccc(cc1)Br
Properties
Complexity:
361  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.019g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
333.244g/mol
Monoisotopic Mass:
332.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties