Cas no 9078-44-8 (2-tert-Butoxycarbonylamino-propionic acid)
9078-44-8 structure
Product Name:2-tert-Butoxycarbonylamino-propionic acid
CAS No:9078-44-8
MF:C8H15NO4
MW:189.209002733231
CID:797825
Update Time:2024-02-02
2-tert-Butoxycarbonylamino-propionic acid Chemical and Physical Properties
Names and Identifiers
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- 2-tert-Butoxycarbonylamino-propionic acid
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- Inchi： 1S/C8H15NO4/c1-5(6(10)11)9-7(12)13-8(2,3)4/h5H,1-4H3,(H,9,12)(H,10,11)
- InChI Key： QVHJQCGUWFKTSE-UHFFFAOYSA-N
- SMILES： C(O)(=O)C(NC(OC(C)(C)C)=O)C
Computed Properties
- Exact Mass: 189.1
- Monoisotopic Mass: 189.1
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 207
- 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
- Topological Polar Surface Area: 75.6A^2
Experimental Properties
- Color/Form: White to off white powder
- Density: 1.126
- Boiling Point: 320.9 °C at 760 mmHg
- Flash Point: 320.9 °C at 760 mmHg
- PSA: 75.63000
- LogP: 1.37510
2-tert-Butoxycarbonylamino-propionic acid Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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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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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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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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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
9078-44-8 (2-tert-Butoxycarbonylamino-propionic acid) Related Products
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