Home Other Building Blocks ALANINE, N-[[4-(2-CHLOROPHENOXY)PHENYL]SULFONYL]-

ALANINE, N-[[4-(2-CHLOROPHENOXY)PHENYL]SULFONYL]-

CAS No.:
1008472-78-3
Catalog Number:
AG00902F
Molecular Formula:
C15H14ClNO5S
Molecular Weight:
355.7934
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Product Description
Catalog Number:
AG00902F
Chemical Name:
ALANINE, N-[[4-(2-CHLOROPHENOXY)PHENYL]SULFONYL]-
CAS Number:
1008472-78-3
Molecular Formula:
C15H14ClNO5S
Molecular Weight:
355.7934
MDL Number:
MFCD03619094
IUPAC Name:
2-[[4-(2-chlorophenoxy)phenyl]sulfonylamino]propanoic acid
InChI:
InChI=1S/C15H14ClNO5S/c1-10(15(18)19)17-23(20,21)12-8-6-11(7-9-12)22-14-5-3-2-4-13(14)16/h2-10,17H,1H3,(H,18,19)
InChI Key:
IETNEQSPEDIHAV-UHFFFAOYSA-N
SMILES:
CC(C(=O)O)NS(=O)(=O)c1ccc(cc1)Oc1ccccc1Cl
Properties
Complexity:
499  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.028g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
355.789g/mol
Monoisotopic Mass:
355.028g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties