2-Acetamido-5-methoxytoluene - CAS 31601-41-9
Catalog: |
BB020990 |
Product Name: |
2-Acetamido-5-methoxytoluene |
CAS: |
31601-41-9 |
Synonyms: |
N-(4-methoxy-2-methylphenyl)acetamide; N-(4-methoxy-2-methylphenyl)acetamide |
IUPAC Name: | N-(4-methoxy-2-methylphenyl)acetamide |
Description: | 2-Acetamido-5-methoxytoluene (CAS# 31601-41-9 ) is a useful research chemical. |
Molecular Weight: | 179.22 |
Molecular Formula: | C10H13NO2 |
Canonical SMILES: | CC1=C(C=CC(=C1)OC)NC(=O)C |
InChI: | InChI=1S/C10H13NO2/c1-7-6-9(13-3)4-5-10(7)11-8(2)12/h4-6H,1-3H3,(H,11,12) |
InChI Key: | AYRUKGQCGNNMLA-UHFFFAOYSA-N |
Boiling Point: | 336.6 ℃ at 760 mmHg |
Density: | 1.1 g/cm3 |
Solubility: | >26.9 [ug/mL] (The mean of the results at pH 7.4) |
LogP: | 2.03500 |
Publication Number | Title | Priority Date |
CN-108069868-B | Method for preparing organic amide compound from aryl diazo tetrafluoroborate and nitrile | 20180119 |
CN-107531685-B | Compounds with antitumor activity | 20150205 |
US-2017122958-A1 | Enzymes Functional Probes | 20131128 |
EP-2914575-B1 | Plasminogen activator-1 inhibitors and methods of use thereof | 20121031 |
US-2013116247-A1 | IRE-1alpha INHIBITORS | 20100405 |
Complexity: | 182 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 179.094628657 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 179.094628657 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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