Cas no 89326-68-1 (Benzenepentanoic acid, 4-acetyl-)
89326-68-1 structure
Product Name:Benzenepentanoic acid, 4-acetyl-
CAS No:89326-68-1
MF:C13H16O3
MW:220.264344215393
CID:604156
PubChem ID:21937109
Update Time:2025-04-19
Benzenepentanoic acid, 4-acetyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenepentanoic acid, 4-acetyl-
- 5-(4-acetylphenyl)pentanoic acid
- 89326-68-1
- SCHEMBL2212719
- 5-(4-Acetylphenyl)valeric acid
- VJKHPZKUHNQYHL-UHFFFAOYSA-N
- DTXSID50620373
-
- Inchi： 1S/C13H16O3/c1-10(14)12-8-6-11(7-9-12)4-2-3-5-13(15)16/h6-9H,2-5H2,1H3,(H,15,16)
- InChI Key： VJKHPZKUHNQYHL-UHFFFAOYSA-N
- SMILES： OC(CCCCC1C=CC(C(C)=O)=CC=1)=O
Computed Properties
- Exact Mass: 220.109944368g/mol
- Monoisotopic Mass: 220.109944368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 6
- Complexity: 240
- 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: 2.4
- Topological Polar Surface Area: 54.4?2
Benzenepentanoic acid, 4-acetyl- Related Literature
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
89326-68-1 (Benzenepentanoic acid, 4-acetyl-) Related Products
- 2051-95-8(3-Benzoylpropionic acid)
- 36330-85-5(Fenbufen)
- 18847-18-2(Benzenepentanoic acid,4-(1-methylethyl)-d-oxo-)
- 4619-20-9(4-(4-Methylphenyl)-4-oxobutanoic Acid)
- 66147-75-9(7-Oxo-8-phenyloctanoic Acid)
- 1501-05-9(5-Oxo-5-phenylpentanoic acid)
- 1590-22-3(3-(2-Naphthoyl)propionic Acid)
- 7472-43-7(7-Oxo-7-phenylheptanoic acid)
- 49594-75-4(4-Ethyl-γ-oxobenzenebutanoic Acid)
- 4144-62-1(5-Benzoylpentanoic acid)
Recommended suppliers
Beyond Pharmaceutical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
Shenzhen GeneSeqTools Bioscience & Technology Co. Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Hangzhou Cedareal Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shanghai Hongxiang Biomedical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shanghai Pearlk Chemicals Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk