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309254-00-0 | Aziridine, 2-methyl-3-phenyl-1-(phenylmethyl)-, (2S,3R)-
CAS No: 309254-00-0 Catalog No: AG0031ON MDL No:
Product Description
Catalog Number:
AG0031ON
Chemical Name:
Aziridine, 2-methyl-3-phenyl-1-(phenylmethyl)-, (2S,3R)-
CAS Number:
309254-00-0
Molecular Formula:
C16H17N
Molecular Weight:
223.3129
IUPAC Name:
(2S,3R)-1-benzyl-2-methyl-3-phenylaziridine
InChI:
InChI=1S/C16H17N/c1-13-16(15-10-6-3-7-11-15)17(13)12-14-8-4-2-5-9-14/h2-11,13,16H,12H2,1H3/t13-,16-,17?/m0/s1
InChI Key:
VHYVNBWQVMBWEM-CCBDSKLWSA-N
SMILES:
C[C@@H]1N([C@@H]1c1ccccc1)Cc1ccccc1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
223.136g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.319g/mol
Monoisotopic Mass:
223.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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