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Home > Nitro Compounds > 326898-43-5
326898-43-5 | N-N-Hexyl-3-nitrobenzamide
CAS No: 326898-43-5 Catalog No: AG00I67Q MDL No:
Product Description
Catalog Number:
AG00I67Q
Chemical Name:
N-N-Hexyl-3-nitrobenzamide
CAS Number:
326898-43-5
IUPAC Name:
N-hexyl-3-nitrobenzamide
InChI:
InChI=1S/C13H18N2O3/c1-2-3-4-5-9-14-13(16)11-7-6-8-12(10-11)15(17)18/h6-8,10H,2-5,9H2,1H3,(H,14,16)
InChI Key:
YERQLXLQESIFPB-UHFFFAOYSA-N
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.132g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.298g/mol
Monoisotopic Mass:
250.132g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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