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86451-28-7 | Aziridine, 1,2-bis(4-methoxyphenyl)-
CAS No: 86451-28-7 Catalog No: AG004XA7 MDL No:
Product Description
Catalog Number:
AG004XA7
Chemical Name:
Aziridine, 1,2-bis(4-methoxyphenyl)-
CAS Number:
86451-28-7
Molecular Formula:
C16H17NO2
Molecular Weight:
255.3117
IUPAC Name:
1,2-bis(4-methoxyphenyl)aziridine
InChI:
InChI=1S/C16H17NO2/c1-18-14-7-3-12(4-8-14)16-11-17(16)13-5-9-15(19-2)10-6-13/h3-10,16H,11H2,1-2H3
InChI Key:
UDUIDFRFOQOUGJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)N1CC1c1ccc(cc1)OC
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.126g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.317g/mol
Monoisotopic Mass:
255.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
21.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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