Cas no 3454-30-6 (4-Ethyl-2,6-di(propan-2-yl)benzene-1,3-diamine)
3454-30-6 structure
Product Name:4-Ethyl-2,6-di(propan-2-yl)benzene-1,3-diamine
CAS No:3454-30-6
MF:C14H24N2
MW:220.353763580322
CID:2823092
PubChem ID:71359831
Update Time:2025-04-21
4-Ethyl-2,6-di(propan-2-yl)benzene-1,3-diamine Chemical and Physical Properties
Names and Identifiers
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- 3454-30-6
- SCHEMBL21808365
- DTXSID20783666
- 4-Ethyl-2,6-di(propan-2-yl)benzene-1,3-diamine
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- Inchi: 1S/C14H24N2/c1-6-10-7-11(8(2)3)14(16)12(9(4)5)13(10)15/h7-9H,6,15-16H2,1-5H3
- InChI Key: GOOQVOJZBVFHDJ-UHFFFAOYSA-N
- SMILES: NC1C(=CC(CC)=C(C=1C(C)C)N)C(C)C
Computed Properties
- Exact Mass: 220.193948774Da
- Monoisotopic Mass: 220.193948774Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 213
- 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: 3.6
- Topological Polar Surface Area: 52?2
4-Ethyl-2,6-di(propan-2-yl)benzene-1,3-diamine Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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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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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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