Cas no 252193-58-1 (1-Propanone,1-(4-chlorophenyl)-2-[(1,1-dimethylethyl)amino]-)
![1-Propanone,1-(4-chlorophenyl)-2-[(1,1-dimethylethyl)amino]- structure](https://ossimg.kuujia.com/scimg/252500/252193-58-1x500.png)
252193-58-1 structure
Product Name:1-Propanone,1-(4-chlorophenyl)-2-[(1,1-dimethylethyl)amino]-
CAS No:252193-58-1
MF:C13H18ClNO
MW:239.741122722626
CID:253260
PubChem ID:3031066
Update Time:2025-04-19
1-Propanone,1-(4-chlorophenyl)-2-[(1,1-dimethylethyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- 1-Propanone,1-(4-chlorophenyl)-2-[(1,1-dimethylethyl)amino]-
- 1-PROPANONE, 1-(4-CHLOROPHENYL)-2-[(1,1-DIMETHYLETHYL)AMINO]- (9CL)
- 2-(N-tert-butylamino)-4'-chloropropiophenone
- 2-(N-tert-Butylamino)-4''-chloropropiophenone
- UNII-YX53NS5D33
- PD089704
- YX53NS5D33
- SCHEMBL770391
- 252193-58-1
- BDBM50302911
- 1-(4-Chlorophenyl)-2-((1,1-dimethylethyl)amino)-1-propanone
- CHEMBL566000
- 2-(tert-butylamino)-1-(4-chlorophenyl)propan-1-one
- 1-Propanone, 1-(4-chlorophenyl)-2-((1,1-dimethylethyl)amino)-
- 2-(tert-Butylamino)-4'-chloropropiophenone
-
- Inchi： 1S/C13H18ClNO/c1-9(15-13(2,3)4)12(16)10-5-7-11(14)8-6-10/h5-9,15H,1-4H3
- InChI Key： IELBAACIVCODPI-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)C(C(C)NC(C)(C)C)=O
Computed Properties
- Exact Mass: 239.1076919g/mol
- Monoisotopic Mass: 239.1076919g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 239
- 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: 3.2
- Topological Polar Surface Area: 29.1?2
1-Propanone,1-(4-chlorophenyl)-2-[(1,1-dimethylethyl)amino]- Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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