Cas no 5503-99-1 (3-ethoxy-4-hexoxybenzaldehyde)
3-ethoxy-4-hexoxybenzaldehyde structure
Product Name:3-ethoxy-4-hexoxybenzaldehyde
CAS No:5503-99-1
MF:C15H22O3
MW:250.333384990692
CID:1594737
PubChem ID:5234810
Update Time:2025-04-21
3-ethoxy-4-hexoxybenzaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 3-ethoxy-4-hexoxybenzaldehyde
- G70871
- BBL035003
- MFCD09718759
- VS-12808
- 3-ethoxy-4-hexoxy-benzaldehyde
- DB-128339
- STL417569
- 3-ethoxy-4-(hexyloxy)benzaldehyde
- 5503-99-1
- starbld0036486
- SCHEMBL4940154
- AKOS005872939
- 339074-51-0
- DTXSID20412080
- 4-(n-hexyloxy)-3-ethoxy-benzaldehyde
-
- Inchi： 1S/C15H22O3/c1-3-5-6-7-10-18-14-9-8-13(12-16)11-15(14)17-4-2/h8-9,11-12H,3-7,10H2,1-2H3
- InChI Key： UKYSGFDCRKZKPC-UHFFFAOYSA-N
- SMILES： O(C1C=CC(C=O)=CC=1OCC)CCCCCC
Computed Properties
- Exact Mass: 250.15696
- Monoisotopic Mass: 250.15689456g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 9
- Complexity: 218
- 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: 4.3
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
3-ethoxy-4-hexoxybenzaldehyde Related Literature
-
Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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