Cas no 348618-45-1 (Benzenepropanenitrile, 2-bromo-5-methoxy-4-(phenylmethoxy)-)
348618-45-1 structure
Product Name:Benzenepropanenitrile, 2-bromo-5-methoxy-4-(phenylmethoxy)-
CAS No:348618-45-1
MF:C17H16BrNO2
MW:346.218443870544
CID:1466735
Update Time:2024-08-25
Benzenepropanenitrile, 2-bromo-5-methoxy-4-(phenylmethoxy)- Chemical and Physical Properties
Names and Identifiers
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- Benzenepropanenitrile, 2-bromo-5-methoxy-4-(phenylmethoxy)-
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- Inchi： 1S/C17H16BrNO2/c1-20-16-10-14(8-5-9-19)15(18)11-17(16)21-12-13-6-3-2-4-7-13/h2-4,6-7,10-11H,5,8,12H2,1H3
- InChI Key： XKWUOPFKNAQALG-UHFFFAOYSA-N
- SMILES： C1(CCC#N)=CC(OC)=C(OCC2=CC=CC=C2)C=C1Br
Computed Properties
- Exact Mass: 345.03648
Experimental Properties
- Density: 1.346±0.06 g/cm3(Predicted)
- Melting Point: 52-53 °C
- Boiling Point: 480.7±40.0 °C(Predicted)
- PSA: 42.25
Benzenepropanenitrile, 2-bromo-5-methoxy-4-(phenylmethoxy)- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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