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Home > Boronic Acids > 871329-79-2
871329-79-2 | (3-(N-Cyclohexylsulfamoyl)phenyl)boronic acid
CAS No: 871329-79-2 Catalog No: AG004KMB MDL No:MFCD07783859
Product Description
Catalog Number:
AG004KMB
Chemical Name:
(3-(N-Cyclohexylsulfamoyl)phenyl)boronic acid
CAS Number:
871329-79-2
Molecular Formula:
C12H18BNO4S
Molecular Weight:
283.1516
MDL Number:
MFCD07783859
IUPAC Name:
[3-(cyclohexylsulfamoyl)phenyl]boronic acid
InChI:
InChI=1S/C12H18BNO4S/c15-13(16)10-5-4-8-12(9-10)19(17,18)14-11-6-2-1-3-7-11/h4-5,8-9,11,14-16H,1-3,6-7H2
InChI Key:
LSHHIHODRSZFHE-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)S(=O)(=O)NC1CCCCC1)O
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.105g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
283.149g/mol
Monoisotopic Mass:
283.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
95A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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