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156222-21-8 | 2-Pyrrolidinol, 1-[(4-methylphenyl)sulfonyl]-
CAS No: 156222-21-8 Catalog No: AG001OLS MDL No:
Product Description
Catalog Number:
AG001OLS
Chemical Name:
2-Pyrrolidinol, 1-[(4-methylphenyl)sulfonyl]-
CAS Number:
156222-21-8
Molecular Formula:
C11H15NO3S
Molecular Weight:
241.3067
IUPAC Name:
1-(4-methylphenyl)sulfonylpyrrolidin-2-ol
InChI:
InChI=1S/C11H15NO3S/c1-9-4-6-10(7-5-9)16(14,15)12-8-2-3-11(12)13/h4-7,11,13H,2-3,8H2,1H3
InChI Key:
HQPGMIATHIJFNS-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)N1CCCC1O
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.077g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.305g/mol
Monoisotopic Mass:
241.077g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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