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1261231-14-4 | 3-Pyrrolidinol, 1-(2-thienylsulfonyl)-
CAS No: 1261231-14-4 Catalog No: AG000RNM MDL No:MFCD17248631
Product Description
Catalog Number:
AG000RNM
Chemical Name:
3-Pyrrolidinol, 1-(2-thienylsulfonyl)-
CAS Number:
1261231-14-4
Molecular Formula:
C8H11NO3S2
Molecular Weight:
233.3078
MDL Number:
MFCD17248631
IUPAC Name:
1-thiophen-2-ylsulfonylpyrrolidin-3-ol
InChI:
InChI=1S/C8H11NO3S2/c10-7-3-4-9(6-7)14(11,12)8-2-1-5-13-8/h1-2,5,7,10H,3-4,6H2
InChI Key:
BOAZCYGWVCAQJI-UHFFFAOYSA-N
SMILES:
OC1CCN(C1)S(=O)(=O)c1cccs1
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.018g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.3g/mol
Monoisotopic Mass:
233.018g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
94.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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