Cas no 6941-15-7 (1-Propanone,3-amino-1-(4-methylphenyl)-, hydrochloride (1:1))
6941-15-7 structure
Product Name:1-Propanone,3-amino-1-(4-methylphenyl)-, hydrochloride (1:1)
CAS No:6941-15-7
MF:C10H14ClNO
MW:199.677261829376
CID:528380
PubChem ID:54602394
Update Time:2025-04-19
1-Propanone,3-amino-1-(4-methylphenyl)-, hydrochloride (1:1) Chemical and Physical Properties
Names and Identifiers
-
- 1-Propanone,3-amino-1-(4-methylphenyl)-, hydrochloride (1:1)
- 3-amino-1-(4-methylphenyl)propan-1-one,hydrochloride
- 6941-15-7
- NSC60482
- NSC-60482
- 3-Amino-1-(4-methylphenyl)propan-1-one--hydrogen chloride (1/1)
- DTXSID30713338
-
- Inchi: 1S/C10H13NO.ClH/c1-8-2-4-9(5-3-8)10(12)6-7-11;/h2-5H,6-7,11H2,1H3;1H
- InChI Key: PIHUBPHNWSJLDY-UHFFFAOYSA-N
- SMILES: Cl.O=C(C1C=CC(C)=CC=1)CCN
Computed Properties
- Exact Mass: 163.09979
- Monoisotopic Mass: 199.076
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 148
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 43.1A^2
Experimental Properties
- Density: 1.036
- Boiling Point: 295.2°Cat760mmHg
- Flash Point: 132.3°C
- Refractive Index: 1.538
- PSA: 43.09
- LogP: 3.02880
1-Propanone,3-amino-1-(4-methylphenyl)-, hydrochloride (1:1) Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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