Cas no 893737-34-3 (Benzaldehyde,3-(2,3-dihydro-1,4-benzodioxin-6-yl)-)
893737-34-3 structure
Product Name:Benzaldehyde,3-(2,3-dihydro-1,4-benzodioxin-6-yl)-
CAS No:893737-34-3
MF:C15H11NO
MW:221.253943681717
CID:714671
Update Time:2024-01-31
Benzaldehyde,3-(2,3-dihydro-1,4-benzodioxin-6-yl)- Chemical and Physical Properties
Names and Identifiers
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- Benzaldehyde,3-(2,3-dihydro-1,4-benzodioxin-6-yl)-
- 3-(1H-INDOL-4-YL)BENZALDEHYDE
- 3-(1-Oxo-2,3-dihydroinden-5-yl)benzaldehyde
- 3-(2,3-Dihydrobenzodioxin-6-yl)benzaldehyde
- 3-(2-Oxo-2,3-dihydrobenzothiazol-6-yl)benzaldehyde
- 3-(3-Oxo-3,4-dihydro-2H-benzothiazin-7-yl)benzaldehyde
- 3-(3-Oxo-indan-5-yl)-benzaldehyde
- 3-(4-Oxo-chromen-6-yl)benzaldehyde
- Benzaldehyde,3-(2,3-dihydro-1,4-benzodioxin-6-yl)
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- MDL： MFCD06802340
- Inchi： 1S/C15H11NO/c17-10-11-3-1-4-12(9-11)13-5-2-6-15-14(13)7-8-16-15/h1-10,16H
- InChI Key： OYCWAHMMGPFEOW-UHFFFAOYSA-N
- SMILES： C(=O)C1=CC=CC(C2=CC=CC3=C2C=CN3)=C1
Computed Properties
- Exact Mass: 221.08400
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 278
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 3.1
Experimental Properties
- PSA: 32.86000
- LogP: 3.64740
Benzaldehyde,3-(2,3-dihydro-1,4-benzodioxin-6-yl)- Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
893737-34-3 (Benzaldehyde,3-(2,3-dihydro-1,4-benzodioxin-6-yl)-) Related Products
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