Cas no 61561-54-4 (Benzeneacetic acid, 2-(3-methylbenzoyl)-)
61561-54-4 structure
Product Name:Benzeneacetic acid, 2-(3-methylbenzoyl)-
CAS No:61561-54-4
MF:C16H14O3
MW:254.280564785004
CID:474807
PubChem ID:15621215
Update Time:2025-04-19
Benzeneacetic acid, 2-(3-methylbenzoyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetic acid, 2-(3-methylbenzoyl)-
- 2-[2-(3-methylbenzoyl)phenyl]acetic acid
- DTXSID00575920
- [2-(3-Methylbenzoyl)phenyl]acetic acid
- 61561-54-4
-
- Inchi： 1S/C16H14O3/c1-11-5-4-7-13(9-11)16(19)14-8-3-2-6-12(14)10-15(17)18/h2-9H,10H2,1H3,(H,17,18)
- InChI Key： VZHKYVMZDSDDFW-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC=C(C)C=1)C1C=CC=CC=1CC(=O)O
Computed Properties
- Exact Mass: 254.09432
- Monoisotopic Mass: 254.094294304g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 337
- 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: 3.1
- Topological Polar Surface Area: 54.4?2
Experimental Properties
- PSA: 54.37
Benzeneacetic acid, 2-(3-methylbenzoyl)- Related Literature
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
61561-54-4 (Benzeneacetic acid, 2-(3-methylbenzoyl)-) Related Products
- 22071-22-3(Desmethyl Ketoprofen)
- 23107-96-2(Benzeneacetic acid,2-benzoyl-)
- 1723-55-3(2-(2-Formylphenyl)acetic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
Recommended suppliers
Shenzhen Yaoyuan R&D Center Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Jiangsu Kolod Food Ingredients Co.,ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Jinan Hanyu Chemical Co.,Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shaanxi pure crystal photoelectric technology co. LTD
Gold Member
Audited Supplier
CN Supplier
Reagent
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
