Cas no 39695-18-6 (Benzene,[(dodecyloxy)methyl]-)
![Benzene,[(dodecyloxy)methyl]- structure](https://ossimg.kuujia.com/scimg/40000/39695-18-6x500.png)
Benzene,[(dodecyloxy)methyl]- structure
Product Name:Benzene,[(dodecyloxy)methyl]-
CAS No:39695-18-6
MF:C19H32O
MW:276.456786155701
CID:321347
PubChem ID:251351
Update Time:2025-04-19
Benzene,[(dodecyloxy)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,[(dodecyloxy)methyl]-
- dodecoxymethylbenzene
- 1-Benzyloxy-dodecan
- 1-PHENYLMETHOXYDODECANE
- benzyl dodecyl ether
- Benzyl-dodecyl-aether
- SCHEMBL7120703
- NSC-71651
- [(dodecyloxy)methyl]benzene
- 39695-18-6
- DTXSID20290901
- NCIOpen2_003646
- NSC71651
-
- Inchi： 1S/C19H32O/c1-2-3-4-5-6-7-8-9-10-14-17-20-18-19-15-12-11-13-16-19/h11-13,15-16H,2-10,14,17-18H2,1H3
- InChI Key： UZQPWASKVYDSRV-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)CCCCCCCCCCCC
Computed Properties
- Exact Mass: 276.24500
- Monoisotopic Mass: 276.245315640g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 20
- Rotatable Bond Count: 13
- Complexity: 184
- 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: 7.2
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23000
- LogP: 6.12410
Benzene,[(dodecyloxy)methyl]- Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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