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Home > Boronic Acids > 486422-57-5
486422-57-5 | 4-(1-PYRROLIDINYLSULFONYL)PHENYLBORONIC ACID
CAS No: 486422-57-5 Catalog No: AG00D9RD MDL No:MFCD06659847
Product Description
Catalog Number:
AG00D9RD
Chemical Name:
4-(1-PYRROLIDINYLSULFONYL)PHENYLBORONIC ACID
CAS Number:
486422-57-5
Molecular Formula:
C10H14BNO4S
Molecular Weight:
255.0985
MDL Number:
MFCD06659847
IUPAC Name:
(4-pyrrolidin-1-ylsulfonylphenyl)boronic acid
InChI:
InChI=1S/C10H14BNO4S/c13-11(14)9-3-5-10(6-4-9)17(15,16)12-7-1-2-8-12/h3-6,13-14H,1-2,7-8H2
InChI Key:
LSQCNEYLDWKDHO-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)S(=O)(=O)N1CCCC1)O
Properties
Complexity:
340
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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