Cas no 6975-35-5 (Dodecanoic acid,2-(dibutoxyphosphinyl)-, ethyl ester)
6975-35-5 structure
Product Name:Dodecanoic acid,2-(dibutoxyphosphinyl)-, ethyl ester
CAS No:6975-35-5
MF:C22H45O5P
MW:420.563468694687
CID:520316
PubChem ID:229057
Update Time:2025-04-19
Dodecanoic acid,2-(dibutoxyphosphinyl)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Dodecanoic acid,2-(dibutoxyphosphinyl)-, ethyl ester
- ethyl 2-dibutoxyphosphoryldodecanoate
- 2-dibutoxyphosphoryl-dodecanoic acid ethyl ester
- 2-Dibutoxyphosphoryl-dodecansaeure-aethylester
- AC1L5GOO
- AC1Q63YE
- AG-K-28593
- AR-1I8059
- CTK5D1240
- ethyl 2-(dibutoxyphosphoryl)dodecanoate
- NSC22427
- DTXSID50281660
- NSC-22427
- 6975-35-5
-
- Inchi： 1S/C22H45O5P/c1-5-9-12-13-14-15-16-17-18-21(22(23)25-8-4)28(24,26-19-10-6-2)27-20-11-7-3/h21H,5-20H2,1-4H3
- InChI Key： MLZFYRJHSLXFLK-UHFFFAOYSA-N
- SMILES： P(C(C(=O)OCC)CCCCCCCCCC)(=O)(OCCCC)OCCCC
Computed Properties
- Exact Mass: 420.30065
- Monoisotopic Mass: 420.30046153g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 28
- Rotatable Bond Count: 21
- Complexity: 400
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 7.3
- Topological Polar Surface Area: 61.8?2
Experimental Properties
- PSA: 61.83
- LogP: 7.27540
Dodecanoic acid,2-(dibutoxyphosphinyl)-, ethyl ester Related Literature
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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