Cas no 81119-33-7 (4-(2-Aminoethyl)phenol; N-Dotriacontanoyl)
81119-33-7 structure
Product Name:4-(2-Aminoethyl)phenol; N-Dotriacontanoyl
CAS No:81119-33-7
MF:C40H73NO2
MW:600.013132810593
CID:730742
Update Time:2024-03-01
4-(2-Aminoethyl)phenol; N-Dotriacontanoyl Chemical and Physical Properties
Names and Identifiers
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- Dotriacontanamide,N-[2-(4-hydroxyphenyl)ethyl]-
- Acalyphamide
- CID 102146496
- Dotriacontanamide, N-[2-(4-hydroxyphenyl)ethyl]-
- 4-(2-Aminoethyl)phenol; N-Dotriacontanoyl
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- Inchi： 1S/C40H73NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-40(43)41-37-36-38-32-34-39(42)35-33-38/h32-35,42H,2-31,36-37H2,1H3,(H,41,43)
- InChI Key： JXEPDSRWVYTNJT-UHFFFAOYSA-N
- SMILES： O=C(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)NCCC1C=CC(=CC=1)O
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 43
- Rotatable Bond Count: 33
- Complexity: 557
- Topological Polar Surface Area: 49.3
Experimental Properties
- Density: 0.916±0.06 g/cm3(Predicted)
- Boiling Point: 715.6±43.0 °C(Predicted)
- pka: 10.01±0.15(Predicted)
4-(2-Aminoethyl)phenol; N-Dotriacontanoyl Related Literature
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Ruili Liu,Mengping Gao,Jing Zhang,Zhilian Li,Jinyang Chen,Ping Liu,Dongqing Wu RSC Adv., 2015,5, 24205-24209
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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Nduka Ikpo,Jenna C. Flogeras,Francesca M. Kerton Dalton Trans., 2013,42, 8998-9006
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