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13784-85-5 | Aziridine, 1,1'-(sulfonyldi-2,1-ethanediyl)bis- (9CI)
CAS No: 13784-85-5 Catalog No: AG0013XS MDL No:
Product Description
Catalog Number:
AG0013XS
Chemical Name:
Aziridine, 1,1'-(sulfonyldi-2,1-ethanediyl)bis- (9CI)
CAS Number:
13784-85-5
Molecular Formula:
C8H16N2O2S
Molecular Weight:
204.2898
IUPAC Name:
1-[2-[2-(aziridin-1-yl)ethylsulfonyl]ethyl]aziridine
InChI:
InChI=1S/C8H16N2O2S/c11-13(12,7-5-9-1-2-9)8-6-10-3-4-10/h1-8H2
InChI Key:
YAJMVBVTMODENJ-UHFFFAOYSA-N
SMILES:
O=S(=O)(CCN1CC1)CCN1CC1
NSC Number:
45080
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.093g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.288g/mol
Monoisotopic Mass:
204.093g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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