Cas no 914486-13-8 (1,3,5-Triazin-2(1H)-one, 4-amino-6-(ethenylamino)-)
914486-13-8 structure
Product Name:1,3,5-Triazin-2(1H)-one, 4-amino-6-(ethenylamino)-
CAS No:914486-13-8
MF:C5H7N5O
MW:153.141979455948
CID:787569
PubChem ID:136236753
Update Time:2025-04-19
1,3,5-Triazin-2(1H)-one, 4-amino-6-(ethenylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 1,3,5-Triazin-2(1H)-one, 4-amino-6-(ethenylamino)-
- 2-amino-6-(ethenylamino)-1H-1,3,5-triazin-4-one
- 4-Amino-6-(vinylamino)-1,3,5-triazin-2(1H)-one
- DTXSID10847640
- 914486-13-8
- 4-Amino-6-(ethenylamino)-1,3,5-triazin-2(5H)-one
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- Inchi： 1S/C5H7N5O/c1-2-7-4-8-3(6)9-5(11)10-4/h2H,1H2,(H4,6,7,8,9,10,11)
- InChI Key： RTEMRUGYWGUNKM-UHFFFAOYSA-N
- SMILES： O=C1N=C(NC=C)N=C(N)N1
Computed Properties
- Exact Mass: 153.06505986g/mol
- Monoisotopic Mass: 153.06505986g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 254
- 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: -0.9
- Topological Polar Surface Area: 91.9?2
1,3,5-Triazin-2(1H)-one, 4-amino-6-(ethenylamino)- Related Literature
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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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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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