Cas no 121007-17-8 (Benzaldehyde,4-hydroxy-3-(3-methyl-3-buten-1-yn-1-yl)-)
121007-17-8 structure
Product Name:Benzaldehyde,4-hydroxy-3-(3-methyl-3-buten-1-yn-1-yl)-
CAS No:121007-17-8
MF:C12H10O2
MW:186.206603527069
CID:162912
PubChem ID:129326
Update Time:2025-04-19
Benzaldehyde,4-hydroxy-3-(3-methyl-3-buten-1-yn-1-yl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde,4-hydroxy-3-(3-methyl-3-buten-1-yn-1-yl)-
- 4-hydroxy-3-(3-methylbut-3-en-1-ynyl)benzaldehyde
- eutypine
- Eutypin
- 4-Hydroxy-3-(3-methyl-3-buten-1-ynyl)benzaldehyde
- Benzaldehyde, 4-hydroxy-3-(3-methyl-3-buten-1-ynyl)-
- AC1L2VEO
- DTXSID60153107
- 4-hydroxy-3-(3-methyl-3-butene-1-ynyl) benzaldehyde
- SCHEMBL272100
- C08448
- CHEMBL501128
- 4-Hydroxy-3-(3-methyl-3-butene-1-ynyl)benzaldehyde
- 121007-17-8
-
- Inchi： 1S/C12H10O2/c1-9(2)3-5-11-7-10(8-13)4-6-12(11)14/h4,6-8,14H,1H2,2H3
- InChI Key： SFCYVTIQMNZUCZ-UHFFFAOYSA-N
- SMILES： OC1=CC=C(C=O)C=C1C#CC(=C)C
Computed Properties
- Exact Mass: 186.06800
- Monoisotopic Mass: 186.068079557g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 292
- 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: 2.8
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.30000
- LogP: 2.13230
Benzaldehyde,4-hydroxy-3-(3-methyl-3-buten-1-yn-1-yl)- Related Literature
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Daniel Jiménez-Teja,Rosario Hernández-Galán,Isidro González Collado Nat. Prod. Rep. 2006 23 108
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Richard N. Strange Nat. Prod. Rep. 2007 24 127
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Peter Spiteller Nat. Prod. Rep. 2015 32 971
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Soleiman E. Helaly,Benjarong Thongbai,Marc Stadler Nat. Prod. Rep. 2018 35 992
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Fernanda Oliveira Chagas,Rita de Cassia Pessotti,Andrés Mauricio Caraballo-Rodríguez,M?nica Tallarico Pupo Chem. Soc. Rev. 2018 47 1652
121007-17-8 (Benzaldehyde,4-hydroxy-3-(3-methyl-3-buten-1-yn-1-yl)-) Related Products
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