Cas no 1129-50-6 (Butanamide, N-phenyl-)
Butanamide, N-phenyl- structure
Product Name:Butanamide, N-phenyl-
Butanamide, N-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Butanamide, N-phenyl-
- butyranilide
- N-phenylbutanamide
- Butyrylanilide
- n-Butyranilide
- N-Phenylbutyramide
- WLN: 4VMR
- AI3-01391
- AKOS003867742
- SCHEMBL9888
- BRN 2207595
- N-Phenylbutanamide #
- NSC6123
- 4-12-00-00387 (Beilstein Handbook Reference)
- 1129-50-6
- DTXSID9061544
- NSC 6123
- N-phenyl-butyramide
- NS00023668
- NSC-6123
- SCHEMBL11591084
- EINECS 214-449-7
- Athylacetanilid
-
- Inchi： 1S/C10H13NO/c1-2-6-10(12)11-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3,(H,11,12)
- InChI Key： UHANVDZCDNSILX-UHFFFAOYSA-N
- SMILES： O=C(CCC)NC1C=CC=CC=1
Computed Properties
- Exact Mass: 163.09979
- Monoisotopic Mass: 163.099714038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 139
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 3
- XLogP3: nothing
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- Density: 1.1340
- Melting Point: 97°C
- Boiling Point: 290.31°C (rough estimate)
- Refractive Index: 1.5718 (estimate)
- PSA: 29.1
Butanamide, N-phenyl- Related Literature
-
Likai Xia,Yong Rok Lee Org. Biomol. Chem. 2013 11 5254
-
Xu Liu,Qian Zhang,Xiaoqing Xin,Rui Zhang,Ning Zhang,Yongjiu Liang,Dewen Dong RSC Adv. 2014 4 36234
-
Fernando H. S. Gama,Rodrigo O. M. A. de Souza,Simon J. Garden RSC Adv. 2015 5 70915
-
Fushuai Li,Xuling Chen,Shuai Liang,Zhenyan Shi,Pengfei Li,Wenjun Li Org. Chem. Front. 2020 7 3446
-
Fushuai Li,Xuling Chen,Shuai Liang,Zhenyan Shi,Pengfei Li,Wenjun Li Org. Chem. Front. 2020 7 3446
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