Cas no 23203-46-5 (Benzenebutanoic acid,4-amino-g,g-dimethyl-)
23203-46-5 structure
Product Name:Benzenebutanoic acid,4-amino-g,g-dimethyl-
CAS No:23203-46-5
MF:C12H17NO2
MW:207.268883466721
CID:286893
PubChem ID:236549
Update Time:2025-04-19
Benzenebutanoic acid,4-amino-g,g-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenebutanoic acid,4-amino-g,g-dimethyl-
- 4-(4-aminophenyl)-4-methylpentanoic acid
- Benzenebutanoic acid,4-amino-g,g-dimethyl
- 23203-46-5
- DTXSID90284812
- NSC39130
- 4-(4-Amino-phenyl)-4-methyl-pentanoic acid
- NSC-39130
-
- Inchi： 1S/C12H17NO2/c1-12(2,8-7-11(14)15)9-3-5-10(13)6-4-9/h3-6H,7-8,13H2,1-2H3,(H,14,15)
- InChI Key： UYPNMPFOGFKGRL-UHFFFAOYSA-N
- SMILES： OC(CCC(C)(C)C1C=CC(=CC=1)N)=O
Computed Properties
- Exact Mass: 207.12600
- Monoisotopic Mass: 207.125928785g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 218
- 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
- XLogP3: 2.2
- Topological Polar Surface Area: 63.3?2
Experimental Properties
- PSA: 63.32000
- LogP: 2.99240
Benzenebutanoic acid,4-amino-g,g-dimethyl- Related Literature
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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2. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
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Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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