Cas no 102657-71-6 (3-chloro-4-dodecoxybenzaldehyde)
102657-71-6 structure
Product Name:3-chloro-4-dodecoxybenzaldehyde
CAS No:102657-71-6
MF:C19H29ClO2
MW:324.885365247726
CID:1133666
PubChem ID:71332846
Update Time:2025-04-20
3-chloro-4-dodecoxybenzaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 3-chloro-4-dodecoxybenzaldehyde
- ACMC-20m5mx
- 3-chloro-4-(dodecyloxy)benzaldehyde
- 3-chloro-4-dodecyloxy-benzaldehyde
- 3-Chlor-4-dodecyloxy-benzaldehyd
- Benzaldehyde, 3-chloro-4-(dodecyloxy)-
- CTK0G7497
- ACMC-20m5mx; 3-chloro-4-(dodecyloxy)benzaldehyde; 3-chloro-4-dodecyloxy-benzaldehyde; 3-Chlor-4-dodecyloxy-benzaldehyd; Benzaldehyde, 3-chloro-4-(dodecyloxy)-; CTK0G7497;
- DTXSID10761216
- 102657-71-6
-
- Inchi： 1S/C19H29ClO2/c1-2-3-4-5-6-7-8-9-10-11-14-22-19-13-12-17(16-21)15-18(19)20/h12-13,15-16H,2-11,14H2,1H3
- InChI Key： NBJWSARBVCFWAS-UHFFFAOYSA-N
- SMILES： ClC1C=C(C=O)C=CC=1OCCCCCCCCCCCC
Computed Properties
- Exact Mass: 324.18577
- Monoisotopic Mass: 324.1856079g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 22
- Rotatable Bond Count: 13
- Complexity: 270
- 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: 7.6
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
3-chloro-4-dodecoxybenzaldehyde Related Literature
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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