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54455-37-7 | N-Chloromethyl-4-nitrophthalimide [for HPLC Labeling]
CAS No: 54455-37-7 Catalog No: AG01FND9 MDL No:MFCD00059889
Product Description
Catalog Number:
AG01FND9
Chemical Name:
N-Chloromethyl-4-nitrophthalimide [for HPLC Labeling]
CAS Number:
54455-37-7
MDL Number:
MFCD00059889
IUPAC Name:
2-(chloromethyl)-5-nitroisoindole-1,3-dione
InChI:
InChI=1S/C9H5ClN2O4/c10-4-11-8(13)6-2-1-5(12(15)16)3-7(6)9(11)14/h1-3H,4H2
InChI Key:
YXMUGXUCSVUONH-UHFFFAOYSA-N
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.994g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.599g/mol
Monoisotopic Mass:
239.994g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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