Cas no 17635-40-4 (2-methoxy-1,3,5-triazine)
2-methoxy-1,3,5-triazine structure
Product Name:2-methoxy-1,3,5-triazine
CAS No:17635-40-4
MF:C4H5N3O
MW:111.101999998093
CID:1363199
PubChem ID:28657
Update Time:2025-04-20
2-methoxy-1,3,5-triazine Chemical and Physical Properties
Names and Identifiers
-
- 2-methoxy-1,3,5-triazine
- 2-METHOXY-S-TRIAZINE
- Q27118037
- 17635-40-4
- methoxy-s-triazine
- DTXSID00274860
- SCHEMBL134812
- CHEBI:38929
-
- Inchi： 1S/C4H5N3O/c1-8-4-6-2-5-3-7-4/h2-3H,1H3
- InChI Key： NCMONXLWVRSCBP-UHFFFAOYSA-N
- SMILES： O(C)C1N=CN=CN=1
Computed Properties
- Exact Mass: 111.04335
- Monoisotopic Mass: 111.043261792g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 8
- Rotatable Bond Count: 1
- Complexity: 62.3
- 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: 0.3
- Topological Polar Surface Area: 47.9?2
Experimental Properties
- PSA: 47.9
2-methoxy-1,3,5-triazine Related Literature
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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