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87975-53-9 | 2-Aziridinesulfonamide, N,N-diethyl-1-(phenylmethyl)-
CAS No: 87975-53-9 Catalog No: AG004IEW MDL No:
Product Description
Catalog Number:
AG004IEW
Chemical Name:
2-Aziridinesulfonamide, N,N-diethyl-1-(phenylmethyl)-
CAS Number:
87975-53-9
Molecular Formula:
C13H20N2O2S
Molecular Weight:
268.3751
IUPAC Name:
1-benzyl-N,N-diethylaziridine-2-sulfonamide
InChI:
InChI=1S/C13H20N2O2S/c1-3-15(4-2)18(16,17)13-11-14(13)10-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3
InChI Key:
CKKWXWKYBCQIPL-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)C1CN1Cc1ccccc1)CC
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.125g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.375g/mol
Monoisotopic Mass:
268.125g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
48.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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