Cas no 312958-46-6 (4-Oxazolecarboxylicacid, 2-[(1R)-1-aminoethyl]-5-methyl-)
![4-Oxazolecarboxylicacid, 2-[(1R)-1-aminoethyl]-5-methyl- structure](https://ossimg.kuujia.com/scimg/313000/312958-46-6x500.png)
312958-46-6 structure
Product Name:4-Oxazolecarboxylicacid, 2-[(1R)-1-aminoethyl]-5-methyl-
CAS No:312958-46-6
MF:C7H10N2O3
MW:170.165901660919
CID:300911
PubChem ID:11389643
Update Time:2025-04-19
4-Oxazolecarboxylicacid, 2-[(1R)-1-aminoethyl]-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Oxazolecarboxylicacid, 2-[(1R)-1-aminoethyl]-5-methyl-
- 4-Oxazolecarboxylicacid,2-[(1R)-1-aminoethyl]-5-methyl-(9CI)
- 2-[(1R)-1-aminoethyl]-5-methyl-1,3-oxazole-4-carboxylic acid
- 312958-46-6
- AKOS027404665
- (R)-2-(1-aminoethyl)-5-methyloxazole-4-carboxylic acid
- DTXSID40464309
-
- Inchi： 1S/C7H10N2O3/c1-3(8)6-9-5(7(10)11)4(2)12-6/h3H,8H2,1-2H3,(H,10,11)/t3-/m1/s1
- InChI Key： PUACPIPASJLDBL-GSVOUGTGSA-N
- SMILES： O1C(C)=C(C(=O)O)N=C1[C@@H](C)N
Computed Properties
- Exact Mass: 170.0692
- Monoisotopic Mass: 170.06914219g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 186
- 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
- XLogP3: -2.4
- Topological Polar Surface Area: 89.4?2
Experimental Properties
- PSA: 89.35
4-Oxazolecarboxylicacid, 2-[(1R)-1-aminoethyl]-5-methyl- Related Literature
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1. Agricultural
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Xingjie Wu,Linzhu Zhou,Yue Su,Chang-Ming Dong J. Mater. Chem. B, 2016,4, 2142-2152
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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