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118335-09-4

118335-09-4 | Boronic acid, [2-[(1,1-dimethylethyl)sulfonyl]phenyl]-

CAS No: 118335-09-4 Catalog No: AG00HEHD MDL No:

Product Description

Catalog Number:
AG00HEHD
Chemical Name:
Boronic acid, [2-[(1,1-dimethylethyl)sulfonyl]phenyl]-
CAS Number:
118335-09-4
IUPAC Name:
(2-tert-butylsulfonylphenyl)boronic acid
InChI:
InChI=1S/C10H15BO4S/c1-10(2,3)16(14,15)9-7-5-4-6-8(9)11(12)13/h4-7,12-13H,1-3H3
InChI Key:
QNWAQPUNFWYYEP-UHFFFAOYSA-N

Properties

Complexity:
326  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.078g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
242.096g/mol
Monoisotopic Mass:
242.078g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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