Cas no 19666-03-6 (Benzoic acid, 2-(1-oxobutyl)-)
Benzoic acid, 2-(1-oxobutyl)- structure
Product Name:Benzoic acid, 2-(1-oxobutyl)-
CAS No:19666-03-6
MF:C11H12O3
MW:192.211183547974
CID:1388431
PubChem ID:21398367
Update Time:2025-09-27
Benzoic acid, 2-(1-oxobutyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 2-(1-oxobutyl)-
- 2-butanoylbenzoic acid
- benzoic acid, 2-butyryl-
- 2-butyrylbenzoic acid
- 19666-03-6
- DTXSID60613079
- SCHEMBL9533934
- 2-butanoyl-benzoic acid
-
- Inchi： 1S/C11H12O3/c1-2-5-10(12)8-6-3-4-7-9(8)11(13)14/h3-4,6-7H,2,5H2,1H3,(H,13,14)
- InChI Key： HSUHAUVCDQLYEW-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC=CC=1C(=O)O)CCC
Computed Properties
- Exact Mass: 192.07866
- Monoisotopic Mass: 192.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 223
- 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: 1.6
- Topological Polar Surface Area: 54.4?2
Experimental Properties
- PSA: 54.37
Benzoic acid, 2-(1-oxobutyl)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| A2B Chem LLC | AD31323-100mg |
Benzoic acid, 2-(1-oxobutyl)- |
19666-03-6 | 100mg |
$858.00 | 2024-04-20 |
Benzoic acid, 2-(1-oxobutyl)- Related Literature
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Shivani Sharma,Chia-Ming Wu,Ranjit T. Koodali,N. Rajesh RSC Adv., 2016,6, 26668-26678
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