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7646-66-4 | Methanone,1-aziridinylphenyl-
CAS No: 7646-66-4 Catalog No: AG005BP7 MDL No:
Product Description
Catalog Number:
AG005BP7
Chemical Name:
Methanone,1-aziridinylphenyl-
CAS Number:
7646-66-4
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
IUPAC Name:
aziridin-1-yl(phenyl)methanone
InChI:
InChI=1S/C9H9NO/c11-9(10-6-7-10)8-4-2-1-3-5-8/h1-5H,6-7H2
InChI Key:
HGBCPYMIZWPKMI-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)N1CC1
EC Number:
231-586-8
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| Asymmetric sulfur ylide mediated aziridination: application in the synthesis of the side chain of taxol. | Organic letters 20031016 |
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