Cas no 87411-29-8 (Butanoic acid, 4-(4-cyanophenoxy)-)
87411-29-8 structure
Product Name:Butanoic acid, 4-(4-cyanophenoxy)-
CAS No:87411-29-8
MF:C11H11NO3
MW:205.209943056107
CID:656568
PubChem ID:22556440
Update Time:2025-04-19
Butanoic acid, 4-(4-cyanophenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid, 4-(4-cyanophenoxy)-
- 4-(4-cyanophenoxy)butanoic acid
- XESIEDAKGYAATA-UHFFFAOYSA-N
- 87411-29-8
- DTXSID70626413
- SCHEMBL4654973
- 4-(4-cyanophenoxy)butyric acid
- AKOS000159795
-
- Inchi： 1S/C11H11NO3/c12-8-9-3-5-10(6-4-9)15-7-1-2-11(13)14/h3-6H,1-2,7H2,(H,13,14)
- InChI Key： XESIEDAKGYAATA-UHFFFAOYSA-N
- SMILES： O(C1C=CC(C#N)=CC=1)CCCC(=O)O
Computed Properties
- Exact Mass: 205.07389321g/mol
- Monoisotopic Mass: 205.07389321g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 248
- 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: 1.5
- Topological Polar Surface Area: 70.3?2
Butanoic acid, 4-(4-cyanophenoxy)- Related Literature
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Xiao Liu,Jun Xu,Yinyun Lv,Wenyu Wu,Weisheng Liu,Yu Tang Dalton Trans., 2013,42, 9840-9846
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2. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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