4-Acetamido-5-nitro-m-xylene - CAS 606-38-2
Catalog: |
BB030760 |
Product Name: |
4-Acetamido-5-nitro-m-xylene |
CAS: |
606-38-2 |
Synonyms: |
N-(2,4-dimethyl-6-nitrophenyl)acetamide; N-(2,4-dimethyl-6-nitrophenyl)acetamide |
IUPAC Name: | N-(2,4-dimethyl-6-nitrophenyl)acetamide |
Description: | 4-Acetamido-5-nitro-m-xylene (CAS# 606-38-2) is a useful intermediate for organic synthesis. |
Molecular Weight: | 208.21 |
Molecular Formula: | C10H12N2O3 |
Canonical SMILES: | CC1=CC(=C(C(=C1)[N+](=O)[O-])NC(=O)C)C |
InChI: | InChI=1S/C10H12N2O3/c1-6-4-7(2)10(11-8(3)13)9(5-6)12(14)15/h4-5H,1-3H3,(H,11,13) |
InChI Key: | PXXMBAOADHXJSE-UHFFFAOYSA-N |
Boiling Point: | 382.8 °C at 760 mmHg |
Density: | 1.247 g/cm3 |
MDL: | MFCD00157615 |
LogP: | 2.76620 |
Publication Number | Title | Priority Date |
CN-111302947-A | Synthetic method of 3, 5-dimethylaniline | 20200324 |
AU-2008240790-A1 | Nicotinic acid derivatives as modulators of metabotropic glutamate receptor-5 | 20070419 |
CA-2682676-A1 | Nicotinic acid derivatives as modulators of metabotropic glutamate receptor-5 | 20070419 |
CN-101679299-A | Nicotinic acid derivatives as modulators of metabotropic glutamate receptor-5 | 20070419 |
EP-2146969-A1 | Nicotinic acid derivatives as modulators of metabotropic glutamate receptor-5 | 20070419 |
Complexity: | 262 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.08479225 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.08479225 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 74.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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