Cas no 70775-88-1 (Amines,C12-14-tert-alkyl, stearates)
70775-88-1 structure
Product Name:Amines,C12-14-tert-alkyl, stearates
CAS No:70775-88-1
MF:C30H63N
MW:437.827929735184
CID:577512
PubChem ID:5748696
Update Time:2025-04-19
Amines,C12-14-tert-alkyl, stearates Chemical and Physical Properties
Names and Identifiers
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- Amines,C12-14-tert-alkyl, stearates
- N-[(3S)-3-tert-butyloctyl]octadecan-1-amine
- 70775-88-1
-
- Inchi： 1S/C30H63N/c1-6-8-10-11-12-13-14-15-16-17-18-19-20-21-22-24-27-31-28-26-29(30(3,4)5)25-23-9-7-2/h29,31H,6-28H2,1-5H3/t29-/m0/s1
- InChI Key： CWRDNSYEVNETGJ-LJAQVGFWSA-N
- SMILES： N(CCCCCCCCCCCCCCCCCC)CC[C@H](CCCCC)C(C)(C)C
Computed Properties
- Exact Mass: 437.49639
- Monoisotopic Mass: 437.496051
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 31
- Rotatable Bond Count: 25
- Complexity: 330
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 12
- XLogP3: 13.7
Experimental Properties
- Density: 0.821
- Boiling Point: 503.3°Cat760mmHg
- Flash Point: 171.2°C
- Refractive Index: 1.454
- PSA: 12.03
Amines,C12-14-tert-alkyl, stearates Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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