Cas no 51-38-7 (Benzoic acid,4-hydroxy-3,5-diiodo-, butyl ester)
51-38-7 structure
Product Name:Benzoic acid,4-hydroxy-3,5-diiodo-, butyl ester
Benzoic acid,4-hydroxy-3,5-diiodo-, butyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,4-hydroxy-3,5-diiodo-, butyl ester
- butyl 4-hydroxy-3,5-diiodobenzoate
- 4-hydroxy-3,5-diiodo-benzoic acid butyl ester
- 4-Hydroxy-3,5-dijod-benzoesaeure-butylester
- AC1L23DY
- Butyl 3,5-diiodo-4-hydroxybenzoate
- Diobene
- Diobutil
- EINECS 200-094-5
- n-Butyl 4-hydroxy-3,5-diiodobenzoate
- AKOS024429315
- 51-38-7
- MVG10P6621
- NSC 60235
- Butyl-4-hydroxy-3,5-dijodbenzoat
- Benzoic acid, 4-hydroxy-3,5-diiodo-, butyl ester
- UNII-MVG10P6621
- BDBM50280386
- Benzoic acid,5-diiodo-, butyl ester
- N-BUTYL-3,5-DIIODO-4-HYDROXYBENZOATE
- NS00032267
- NSC-60235
- Q27284256
- butyl4-hydroxy-3,5-diiodobenzoate
- SCHEMBL6731831
- DTXSID80198999
- NSC60235
- CHEMBL4174801
- C11H12I2O3
- N-butyl-4-hydroxy-3,5-diiodobenzoate
-
- Inchi： 1S/C11H12I2O3/c1-2-3-4-16-11(15)7-5-8(12)10(14)9(13)6-7/h5-6,14H,2-4H2,1H3
- InChI Key： AKPGOBAFPMFHET-UHFFFAOYSA-N
- SMILES： IC1C(=C(C=C(C=1)C(=O)OCCCC)I)O
Computed Properties
- Exact Mass: 445.88666
- Monoisotopic Mass: 445.888
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- 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
- Topological Polar Surface Area: 46.5A^2
- XLogP3: 4
Experimental Properties
- Density: 2.032
- Boiling Point: 371°Cat760mmHg
- Flash Point: 178.2°C
- Refractive Index: 1.645
- PSA: 46.53
- LogP: 3.55830
Benzoic acid,4-hydroxy-3,5-diiodo-, butyl ester Related Literature
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
-
Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
-
5. 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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