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1313617-52-5

1313617-52-5 | 3-(Propylsulfonyl)phenylboronic acid

CAS No: 1313617-52-5 Catalog No: AG00HSFS MDL No:

Product Description

Catalog Number:
AG00HSFS
Chemical Name:
3-(Propylsulfonyl)phenylboronic acid
CAS Number:
1313617-52-5
IUPAC Name:
(3-propylsulfonylphenyl)boronic acid
InChI:
InChI=1S/C9H13BO4S/c1-2-6-15(13,14)9-5-3-4-8(7-9)10(11)12/h3-5,7,11-12H,2,6H2,1H3
InChI Key:
RDRYPJSFNCCHLL-UHFFFAOYSA-N

Properties

Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.063g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
228.069g/mol
Monoisotopic Mass:
228.063g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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