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Home > Pyridines > 796975-18-3
796975-18-3 | Aziridine, 1-[(4-methylphenyl)sulfonyl]-2-(2-pyridinyl)-
CAS No: 796975-18-3 Catalog No: AG0050UV MDL No:
Product Description
Catalog Number:
AG0050UV
Chemical Name:
Aziridine, 1-[(4-methylphenyl)sulfonyl]-2-(2-pyridinyl)-
CAS Number:
796975-18-3
Molecular Formula:
C14H14N2O2S
Molecular Weight:
274.3382
IUPAC Name:
2-[1-(4-methylphenyl)sulfonylaziridin-2-yl]pyridine
InChI:
InChI=1S/C14H14N2O2S/c1-11-5-7-12(8-6-11)19(17,18)16-10-14(16)13-4-2-3-9-15-13/h2-9,14H,10H2,1H3
InChI Key:
IMXWEQIAXXZIMJ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)N1CC1c1ccccn1
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.078g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.338g/mol
Monoisotopic Mass:
274.078g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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