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1003298-86-9 | Boronic acid, B-[3-[(diethylamino)sulfonyl]-4-methoxyphenyl]-
CAS No: 1003298-86-9 Catalog No: AG0001M6 MDL No:MFCD08056367
Product Description
Catalog Number:
AG0001M6
Chemical Name:
Boronic acid, B-[3-[(diethylamino)sulfonyl]-4-methoxyphenyl]-
CAS Number:
1003298-86-9
Molecular Formula:
C11H18BNO5S
Molecular Weight:
287.1403
MDL Number:
MFCD08056367
IUPAC Name:
[3-(diethylsulfamoyl)-4-methoxyphenyl]boronic acid
InChI:
InChI=1S/C11H18BNO5S/c1-4-13(5-2)19(16,17)11-8-9(12(14)15)6-7-10(11)18-3/h6-8,14-15H,4-5H2,1-3H3
InChI Key:
URMKPGLOFMAUIZ-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)c1cc(ccc1OC)B(O)O)CC
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.1g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
287.137g/mol
Monoisotopic Mass:
287.1g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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