Cas no 25496-16-6 (Ethanone,1-(butylphenyl)- (9CI))
25496-16-6 structure
Product Name:Ethanone,1-(butylphenyl)- (9CI)
CAS No:25496-16-6
MF:C12H16O
MW:176.254843711853
CID:285745
PubChem ID:3015233
Update Time:2025-04-19
Ethanone,1-(butylphenyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Ethanone,1-(butylphenyl)- (9CI)
- 1-(2-butylphenyl)ethanone
- 1-(Butylphenyl)ethan-1-one
- 25496-16-6
- SCHEMBL1131361
- EINECS 247-037-0
- NS00027901
- DTXSID30180182
-
- Inchi： 1S/C12H16O/c1-3-4-7-11-8-5-6-9-12(11)10(2)13/h5-6,8-9H,3-4,7H2,1-2H3
- InChI Key： PLPLNIPMXUXDTF-UHFFFAOYSA-N
- SMILES： O=C(C)C1C=CC=CC=1CCCC
Computed Properties
- Exact Mass: 176.12018
- Monoisotopic Mass: 176.120115
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 163
- 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
- Topological Polar Surface Area: 17.1
- XLogP3: 3.5
Experimental Properties
- Density: 0.943
- Boiling Point: 268.2°Cat760mmHg
- Flash Point: 108.1°C
- Refractive Index: 1.501
- PSA: 17.07
Ethanone,1-(butylphenyl)- (9CI) Related Literature
-
Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
Xiao Liu,Jun Xu,Yinyun Lv,Wenyu Wu,Weisheng Liu,Yu Tang Dalton Trans., 2013,42, 9840-9846
-
Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
-
Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
25496-16-6 (Ethanone,1-(butylphenyl)- (9CI)) Related Products
- 89-74-7(2',4'-Dimethylacetophenone)
- 83-33-0(2,3-dihydro-1H-inden-1-one)
- 24623-20-9(6-Methyl-1-indanone)
- 1667-01-2(1-(2,4,6-trimethylphenyl)ethan-1-one)
- 577-16-2(2'-Methylacetophenone)
- 4593-38-8(5-Methyl-1-indanone)
- 826-73-3(6,7,8,9-tetrahydro-5H-benzo7annulen-5-one)
- 1210-35-1(Dibenzosuberone)
- 2040-14-4(2'-Methylpropiophenone)
- 529-34-0(1,2,3,4-tetrahydronaphthalen-1-one)
Recommended suppliers
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Suzhou Genelee Bio-Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Yunnanjiuzhen
Gold Member
Audited Supplier
CN Supplier
Bulk
