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19117-21-6 | Methanone, 1-aziridinyl(4-chlorophenyl)-
CAS No: 19117-21-6 Catalog No: AG002F3M MDL No:
Product Description
Catalog Number:
AG002F3M
Chemical Name:
Methanone, 1-aziridinyl(4-chlorophenyl)-
CAS Number:
19117-21-6
Molecular Formula:
C9H8ClNO
Molecular Weight:
181.6189
IUPAC Name:
aziridin-1-yl-(4-chlorophenyl)methanone
InChI:
InChI=1S/C9H8ClNO/c10-8-3-1-7(2-4-8)9(12)11-5-6-11/h1-4H,5-6H2
InChI Key:
AIUPDSQLYGAORJ-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Cl)N1CC1
NSC Number:
56497
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.029g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.619g/mol
Monoisotopic Mass:
181.029g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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