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210972-39-7 | 2-Aziridinemethanol, 1-[(4-methylphenyl)sulfonyl]-
CAS No: 210972-39-7 Catalog No: AG002L3I MDL No:
Product Description
Catalog Number:
AG002L3I
Chemical Name:
2-Aziridinemethanol, 1-[(4-methylphenyl)sulfonyl]-
CAS Number:
210972-39-7
Molecular Formula:
C10H13NO3S
Molecular Weight:
227.2801
IUPAC Name:
[1-(4-methylphenyl)sulfonylaziridin-2-yl]methanol
InChI:
InChI=1S/C10H13NO3S/c1-8-2-4-10(5-3-8)15(13,14)11-6-9(11)7-12/h2-5,9,12H,6-7H2,1H3
InChI Key:
BDBQXGZJGMVTGC-UHFFFAOYSA-N
SMILES:
OCC1CN1S(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.062g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.278g/mol
Monoisotopic Mass:
227.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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