Home Sulfos N-(4'-Chloro-4-biphenylylsulfonyl)-^b-alanine, 96%

N-(4'-Chloro-4-biphenylylsulfonyl)-^b-alanine, 96%

CAS No.:
885269-40-9
Catalog Number:
AG00H1Q9
Molecular Formula:
C15H14ClNO4S
Molecular Weight:
339.7940
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Product Description
Catalog Number:
AG00H1Q9
Chemical Name:
N-(4'-Chloro-4-biphenylylsulfonyl)-^b-alanine, 96%
CAS Number:
885269-40-9
Molecular Formula:
C15H14ClNO4S
Molecular Weight:
339.7940
MDL Number:
MFCD06409457
IUPAC Name:
3-[[4-(4-chlorophenyl)phenyl]sulfonylamino]propanoic acid
InChI:
InChI=1S/C15H14ClNO4S/c16-13-5-1-11(2-6-13)12-3-7-14(8-4-12)22(20,21)17-10-9-15(18)19/h1-8,17H,9-10H2,(H,18,19)
InChI Key:
ILVCJXYJRKJZDY-UHFFFAOYSA-N
SMILES:
OC(=O)CCNS(=O)(=O)c1ccc(cc1)c1ccc(cc1)Cl
Properties
Complexity:
460  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.033g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
339.79g/mol
Monoisotopic Mass:
339.033g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties