Cas no 66049-87-4 (3-hexadecoxybenzaldehyde)
3-hexadecoxybenzaldehyde structure
Product Name:3-hexadecoxybenzaldehyde
CAS No:66049-87-4
MF:C23H38O2
MW:346.546627521515
CID:963072
PubChem ID:292330
Update Time:2025-04-19
3-hexadecoxybenzaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 3-hexadecoxybenzaldehyde
- 3-(hexadecyloxy)benzaldehyde
- AC1L6HS3
- AC1Q6Q4W
- AG-K-32524
- AR-1E7744
- CTK5C3435
- NSC158045
- NSC-158045
- NSC 158045
- DTXSID10303372
- 66049-87-4
- SCHEMBL8863665
-
- Inchi： 1S/C23H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-25-23-18-16-17-22(20-23)21-24/h16-18,20-21H,2-15,19H2,1H3
- InChI Key： OUXLJXSUHFCQRF-UHFFFAOYSA-N
- SMILES： O(C1C=CC=C(C=O)C=1)CCCCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 346.28700
- Monoisotopic Mass: 346.287180451g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 25
- Rotatable Bond Count: 17
- Complexity: 290
- 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: 9.1
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.30000
- LogP: 7.35920
3-hexadecoxybenzaldehyde Related Literature
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Hailing Chen,Lu Yin,Meng Liu,Laibing Wang,Michiya Fujiki,Wei Zhang RSC Adv., 2019,9, 4849-4856
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
66049-87-4 (3-hexadecoxybenzaldehyde) Related Products
- 50262-46-9(4-N-Nonyloxybenzaldehyde)
- 24083-13-4(4-(Octyloxy)benzaldehyde)
- 27893-41-0(4-Heptyloxybenzaldehyde)
- 5736-88-9(4-Butoxybenzaldehyde)
- 5736-94-7(4-(Hexyloxy)benzaldehyde)
- 24083-16-7(4-Decyloxybenzaldehyde)
- 131525-50-3(3,4-Bis(octyloxy)benzaldehyde)
- 24083-19-0(4-N-Dodecycloxybenzaldehyde)
- 5736-91-4(4-(Pentyloxy)benzaldehyde)
- 123440-34-6(1,4-Benzenedicarboxaldehyde,2,5-bis(octyloxy)-)
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