4'-Chloro-2'-methylacetanilide - CAS 5202-86-8
Catalog: |
BB027687 |
Product Name: |
4'-Chloro-2'-methylacetanilide |
CAS: |
5202-86-8 |
Synonyms: |
N-(4-chloro-2-methylphenyl)acetamide; N-(4-chloro-2-methylphenyl)acetamide |
IUPAC Name: | N-(4-chloro-2-methylphenyl)acetamide |
Description: | 4'-Chloro-2'-methylacetanilide (CAS# 5202-86-8) is a useful research chemical. |
Molecular Weight: | 183.63 |
Molecular Formula: | C9H10ClNO |
Canonical SMILES: | CC1=C(C=CC(=C1)Cl)NC(=O)C |
InChI: | InChI=1S/C9H10ClNO/c1-6-5-8(10)3-4-9(6)11-7(2)12/h3-5H,1-2H3,(H,11,12) |
InChI Key: | WMHHXYOPEQARIN-UHFFFAOYSA-N |
Boiling Point: | 324.3 ℃ at 760 mmHg |
Density: | 1.218 g/cm3 |
MDL: | MFCD00027399 |
LogP: | 2.67980 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113461541-A | Method for synthesizing p-chloro-o-toluidine | 20210701 |
US-10981868-B1 | Single step regioselective cyclization and chlorination of hydroxyamino-N-(2-methylphenyl)acetamide to 5-chloro-7-methylindoline-2,3-dione | 20200812 |
WO-2021113682-A1 | Masp-2 inhibitors and methods of use | 20191204 |
WO-2021113686-A1 | Masp-2 inhibitors and methods of use | 20191204 |
WO-2021113690-A1 | Masp-2 inhibitors and methods of use | 20191204 |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 183.0450916 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 183.0450916 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 29.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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