Cas no 89080-91-1 (Butanamide, 2-acetyl-3-methyl-N-phenyl-)
89080-91-1 structure
Product Name:Butanamide, 2-acetyl-3-methyl-N-phenyl-
CAS No:89080-91-1
MF:C13H17NO2
MW:219.279583692551
CID:613118
PubChem ID:13620974
Update Time:2025-04-19
Butanamide, 2-acetyl-3-methyl-N-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Butanamide, 2-acetyl-3-methyl-N-phenyl-
- 2-acetyl-3-methyl-N-phenylbutanamide
- DTXSID50545214
- 2-acetyl-2-isopropylacetanilide
- SCHEMBL10647387
- 89080-91-1
- KOGGVCFTLJOEPU-UHFFFAOYSA-N
-
- Inchi： 1S/C13H17NO2/c1-9(2)12(10(3)15)13(16)14-11-7-5-4-6-8-11/h4-9,12H,1-3H3,(H,14,16)
- InChI Key： KOGGVCFTLJOEPU-UHFFFAOYSA-N
- SMILES： O=C(C(C(C)=O)C(C)C)NC1C=CC=CC=1
Computed Properties
- Exact Mass: 219.125928785g/mol
- Monoisotopic Mass: 219.125928785g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 255
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 46.2?2
Butanamide, 2-acetyl-3-methyl-N-phenyl- Related Literature
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Jason Wan Lab Chip, 2020,20, 4528-4538
89080-91-1 (Butanamide, 2-acetyl-3-methyl-N-phenyl-) Related Products
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