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36065-80-2 | 2-(p-Nitrophenacylthio)-2-imidazoline
CAS No: 36065-80-2 Catalog No: AG00D2HL MDL No:
Product Description
Catalog Number:
AG00D2HL
Chemical Name:
2-(p-Nitrophenacylthio)-2-imidazoline
CAS Number:
36065-80-2
IUPAC Name:
2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-(4-nitrophenyl)ethanone
InChI:
InChI=1S/C11H11N3O3S/c15-10(7-18-11-12-5-6-13-11)8-1-3-9(4-2-8)14(16)17/h1-4H,5-7H2,(H,12,13)
InChI Key:
SFYBVYGDWXFMAJ-UHFFFAOYSA-N
NSC Number:
220250
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.052g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.287g/mol
Monoisotopic Mass:
265.052g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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