Cas no 28090-15-5 (Benzoic acid,4-[(3-methyl-2-buten-1-yl)oxy]-)
![Benzoic acid,4-[(3-methyl-2-buten-1-yl)oxy]- structure](https://ossimg.kuujia.com/scimg/28500/28090-15-5x500.png)
28090-15-5 structure
Product Name:Benzoic acid,4-[(3-methyl-2-buten-1-yl)oxy]-
CAS No:28090-15-5
MF:C12H14O3
MW:206.237763881683
CID:279620
PubChem ID:267137
Update Time:2025-04-19
Benzoic acid,4-[(3-methyl-2-buten-1-yl)oxy]- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,4-[(3-methyl-2-buten-1-yl)oxy]-
- 4-prenyloxybenzoic acid
- DTXSID20295911
- KLZJDQVTNOMAKU-UHFFFAOYSA-N
- 28090-15-5
- AKOS000202888
- 4-(3-methylbut-2-enoxy)benzoic acid
- A819407
- SCHEMBL3316632
- NSC-106253
- 4-(3-Methyl-but-2-enyloxy)-benzoic acid
- CHEMBL376892
- valencic acid
- NSC106253
-
- Inchi： 1S/C12H14O3/c1-9(2)7-8-15-11-5-3-10(4-6-11)12(13)14/h3-7H,8H2,1-2H3,(H,13,14)
- InChI Key： KLZJDQVTNOMAKU-UHFFFAOYSA-N
- SMILES： O(C1C=CC(C(=O)O)=CC=1)C/C=C(\C)/C
Computed Properties
- Exact Mass: 206.09432
- Monoisotopic Mass: 206.094
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 233
- 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: 3.5
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- Density: 1.112
- Boiling Point: 344°Cat760mmHg
- Flash Point: 130.8°C
- Refractive Index: 1.541
- PSA: 46.53
- LogP: 2.72980
Benzoic acid,4-[(3-methyl-2-buten-1-yl)oxy]- Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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4. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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