Home Sulfos benzyl 4-(ethenesulfonyl)piperazine-1-carboxylate

benzyl 4-(ethenesulfonyl)piperazine-1-carboxylate

CAS No.:
1246203-64-4
Catalog Number:
AG01BBWK
Molecular Formula:
C14H18N2O4S
Molecular Weight:
310.3687
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BBWK
Chemical Name:
benzyl 4-(ethenesulfonyl)piperazine-1-carboxylate
CAS Number:
1246203-64-4
Molecular Formula:
C14H18N2O4S
Molecular Weight:
310.3687
MDL Number:
MFCD29033789
IUPAC Name:
benzyl 4-ethenylsulfonylpiperazine-1-carboxylate
InChI:
InChI=1S/C14H18N2O4S/c1-2-21(18,19)16-10-8-15(9-11-16)14(17)20-12-13-6-4-3-5-7-13/h2-7H,1,8-12H2
InChI Key:
KZTJZXMHRNWSRC-UHFFFAOYSA-N
SMILES:
C=CS(=O)(=O)N1CCN(CC1)C(=O)OCc1ccccc1
Properties
Complexity:
458  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.099g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.368g/mol
Monoisotopic Mass:
310.099g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties