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126437-18-1 | Methanone, (2,2-dimethyl-3-phenyl-1-aziridinyl)phenyl-
CAS No: 126437-18-1 Catalog No: AG000SSI MDL No:
Product Description
Catalog Number:
AG000SSI
Chemical Name:
Methanone, (2,2-dimethyl-3-phenyl-1-aziridinyl)phenyl-
CAS Number:
126437-18-1
Molecular Formula:
C17H17NO
Molecular Weight:
251.3230
IUPAC Name:
(2,2-dimethyl-3-phenylaziridin-1-yl)-phenylmethanone
InChI:
InChI=1S/C17H17NO/c1-17(2)15(13-9-5-3-6-10-13)18(17)16(19)14-11-7-4-8-12-14/h3-12,15H,1-2H3
InChI Key:
JDEQVGAEIPZOEW-UHFFFAOYSA-N
SMILES:
O=C(N1C(C1(C)C)c1ccccc1)c1ccccc1
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.131g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.329g/mol
Monoisotopic Mass:
251.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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