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Home > Nitro Compounds > 88382-10-9
88382-10-9 | Benzamide, N-hydroxy-N-(1-methyl-3-butenyl)-4-nitro-
CAS No: 88382-10-9 Catalog No: AG004M27 MDL No:
Product Description
Catalog Number:
AG004M27
Chemical Name:
Benzamide, N-hydroxy-N-(1-methyl-3-butenyl)-4-nitro-
CAS Number:
88382-10-9
Molecular Formula:
C12H14N2O4
Molecular Weight:
250.2506
IUPAC Name:
N-hydroxy-4-nitro-N-pent-4-en-2-ylbenzamide
InChI:
InChI=1S/C12H14N2O4/c1-3-4-9(2)13(16)12(15)10-5-7-11(8-6-10)14(17)18/h3,5-9,16H,1,4H2,2H3
InChI Key:
YFIBJBACPPNFPZ-UHFFFAOYSA-N
SMILES:
C=CCC(N(C(=O)c1ccc(cc1)[N+](=O)[O-])O)C
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.254g/mol
Monoisotopic Mass:
250.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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