Home Other Building Blocks 2-[4-(cyclopropanesulfinyl)phenyl]acetic acid

2-[4-(cyclopropanesulfinyl)phenyl]acetic acid

CAS No.:
1566048-98-3
Catalog Number:
AG01C4UB
Molecular Formula:
C11H12O3S
Molecular Weight:
224.2762
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Product Description
Catalog Number:
AG01C4UB
Chemical Name:
2-[4-(cyclopropanesulfinyl)phenyl]acetic acid
CAS Number:
1566048-98-3
Molecular Formula:
C11H12O3S
Molecular Weight:
224.2762
MDL Number:
MFCD26832318
IUPAC Name:
2-(4-cyclopropylsulfinylphenyl)acetic acid
InChI:
InChI=1S/C11H12O3S/c12-11(13)7-8-1-3-9(4-2-8)15(14)10-5-6-10/h1-4,10H,5-7H2,(H,12,13)
InChI Key:
SLBVFDSGLFSPGD-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(cc1)S(=O)C1CC1
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.051g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.274g/mol
Monoisotopic Mass:
224.051g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties