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Home > Boronic Acids > 486422-68-8

486422-68-8

486422-68-8 | 4-(morpholinosulfonyl)phenylboronic acid

CAS No: 486422-68-8 Catalog No: AG00DD60 MDL No:MFCD06659844

Product Description

Catalog Number:
AG00DD60
Chemical Name:
4-(morpholinosulfonyl)phenylboronic acid
CAS Number:
486422-68-8
Molecular Formula:
C10H14BNO5S
Molecular Weight:
271.0979
MDL Number:
MFCD06659844
IUPAC Name:
(4-morpholin-4-ylsulfonylphenyl)boronic acid
InChI:
InChI=1S/C10H14BNO5S/c13-11(14)9-1-3-10(4-2-9)18(15,16)12-5-7-17-8-6-12/h1-4,13-14H,5-8H2
InChI Key:
BRRALDPVXKGEEE-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)S(=O)(=O)N1CCOCC1)O

Properties

Complexity:
355  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.069g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
271.094g/mol
Monoisotopic Mass:
271.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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