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Home > Nitro Compounds > 144146-28-1
144146-28-1 | Benzenedodecanoic acid, 4-nitro-
CAS No: 144146-28-1 Catalog No: AG001IZX MDL No:
Product Description
Catalog Number:
AG001IZX
Chemical Name:
Benzenedodecanoic acid, 4-nitro-
CAS Number:
144146-28-1
Molecular Formula:
C18H27NO4
Molecular Weight:
321.4113
IUPAC Name:
12-(4-nitrophenyl)dodecanoic acid
InChI:
InChI=1S/C18H27NO4/c20-18(21)11-9-7-5-3-1-2-4-6-8-10-16-12-14-17(15-13-16)19(22)23/h12-15H,1-11H2,(H,20,21)
InChI Key:
SXYJHRQMXGJSMM-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCCCCCCCc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.194g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
321.417g/mol
Monoisotopic Mass:
321.194g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
Literature
| Title | Journal |
|---|---|
| Components of the E. coli envelope are affected by and can react to protein over-production in the cytoplasm. | Microbial cell factories 20090101 |
| Structure-guided alteration of coenzyme specificity of formate dehydrogenase by saturation mutagenesis to enable efficient utilization of NADP+. | The FEBS journal 20080801 |
| Purification and characterization of lipase in buckwheat seed. | Journal of agricultural and food chemistry 20041201 |
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