Cas no 102877-45-2 (Ethanone,1-(3-amino-5-methylphenyl)-)
102877-45-2 structure
Product Name:Ethanone,1-(3-amino-5-methylphenyl)-
CAS No:102877-45-2
MF:C9H11NO
MW:149.189742326736
CID:125326
PubChem ID:55289114
Update Time:2025-04-18
Ethanone,1-(3-amino-5-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone,1-(3-amino-5-methylphenyl)-
- Acetophenone,3'-amino-5'-methyl- (6CI)
- Acetophenone, 3-amino-5-methyl- (6CI)
- 1-(3-amino-5-methylphenyl)ethanone
- 1-(3-amino-5-methylphenyl)ethan-1-one
- 102877-45-2
- AKOS006360931
- SCHEMBL10066340
-
- Inchi： 1S/C9H11NO/c1-6-3-8(7(2)11)5-9(10)4-6/h3-5H,10H2,1-2H3
- InChI Key： KVDMLHRPIQOTCE-UHFFFAOYSA-N
- SMILES： O=C(C)C1C=C(C=C(C)C=1)N
Computed Properties
- Exact Mass: 149.08413
- Monoisotopic Mass: 149.084
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 156
- 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: 43.1A^2
- XLogP3: 1.3
Experimental Properties
- PSA: 43.09
- LogP: 2.36100
Ethanone,1-(3-amino-5-methylphenyl)- Related Literature
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
102877-45-2 (Ethanone,1-(3-amino-5-methylphenyl)-) Related Products
- 611-79-0(3-(3-aminobenzoyl)aniline)
- 39070-63-8(3,4-Diaminobenzophenone)
- 1137-41-3(4-aminobenzophenone)
- 2835-78-1(3-Aminobenzophenone)
- 1197-05-3(3'-Aminopropiophenone)
- 611-98-3(4,4'-Diaminobenzophenone)
- 17071-24-8(1-(3-Amino-4-methylphenyl)ethanone)
- 7470-88-4(1-(6-Aminonaphthalen-2-yl)ethanone)
- 99-92-3(4'-Aminoacetophenone)
- 99-03-6(1-(3-aminophenyl)ethan-1-one)
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