Cas no 47341-71-9 (Phenol,4-[(1E)-1-ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl]-, 1-(dihydrogen phosphate))
![Phenol,4-[(1E)-1-ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl]-, 1-(dihydrogen phosphate) structure](https://ossimg.kuujia.com/scimg/47500/47341-71-9x500.png)
47341-71-9 structure
Product Name:Phenol,4-[(1E)-1-ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl]-, 1-(dihydrogen phosphate)
CAS No:47341-71-9
MF:C18H21O5P
MW:348.330106496811
CID:330976
PubChem ID:3036959
Update Time:2025-04-19
Phenol,4-[(1E)-1-ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl]-, 1-(dihydrogen phosphate) Chemical and Physical Properties
Names and Identifiers
-
- Phenol,4-[(1E)-1-ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl]-, 1-(dihydrogen phosphate)
- diethylstilbestrol monophosphate
- Fosfestrolmonophosphat
- [4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenyl] dihydrogen phosphate
- Phosphate diethylstilbesterol
- PDES
- SCHEMBL707840
- 47341-71-9
- Des-MP
- Phenol, 4-(1-ethyl-2-(4-hydroxyphenyl)-1-butenyl)-, 1-(dihydrogen phosphate), (E)-
-
- Inchi： 1S/C18H21O5P/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(12-8-14)23-24(20,21)22/h5-12,19H,3-4H2,1-2H3,(H2,20,21,22)/b18-17+
- InChI Key： RBNWMSXZPICYAL-ISLYRVAYSA-N
- SMILES： P(=O)(O)(O)OC1C=CC(=CC=1)/C(/CC)=C(/C1C=CC(=CC=1)O)\CC
Computed Properties
- Exact Mass: 348.11266076g/mol
- Monoisotopic Mass: 348.11266076g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 24
- Rotatable Bond Count: 6
- Complexity: 468
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.8
- Topological Polar Surface Area: 87?2
Phenol,4-[(1E)-1-ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl]-, 1-(dihydrogen phosphate) Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
47341-71-9 (Phenol,4-[(1E)-1-ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl]-, 1-(dihydrogen phosphate)) Related Products
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