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Home > Boronic Acids > 913835-83-3
913835-83-3 | (2-(Pyrrolidin-1-ylsulfonyl);phenyl);boronic acid
CAS No: 913835-83-3 Catalog No: AG006NKE MDL No:MFCD08689515
Product Description
Catalog Number:
AG006NKE
Chemical Name:
(2-(Pyrrolidin-1-ylsulfonyl);phenyl);boronic acid
CAS Number:
913835-83-3
Molecular Formula:
C10H14BNO4S
Molecular Weight:
255.0985
MDL Number:
MFCD08689515
IUPAC Name:
(2-pyrrolidin-1-ylsulfonylphenyl)boronic acid
InChI:
InChI=1S/C10H14BNO4S/c13-11(14)9-5-1-2-6-10(9)17(15,16)12-7-3-4-8-12/h1-2,5-6,13-14H,3-4,7-8H2
InChI Key:
ONRDSHCJDLWHKN-UHFFFAOYSA-N
SMILES:
OB(c1ccccc1S(=O)(=O)N1CCCC1)O
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.074g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
255.095g/mol
Monoisotopic Mass:
255.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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