Cas no 426837-12-9 (1,3,5-Triazin-2(1H)-one,6-amino-, hydrate (1:1))
426837-12-9 structure
Product Name:1,3,5-Triazin-2(1H)-one,6-amino-, hydrate (1:1)
CAS No:426837-12-9
MF:C3H6N4O2
MW:130.10533952713
CID:326838
PubChem ID:18531479
Update Time:2025-04-19
1,3,5-Triazin-2(1H)-one,6-amino-, hydrate (1:1) Chemical and Physical Properties
Names and Identifiers
-
- 1,3,5-Triazin-2(1H)-one,6-amino-, hydrate (1:1)
- 1,3,5-Triazin-2(1H)-one,4-amino-,monohydrate(9CI)
- MFCD00149402
- 2-Amino-4-hydroxy-1,3,5-triazine hydrate; 98%
- 426837-12-9
- 4-Amino-1,3,5-triazin-2(1H)-onehydrate
- 5-Azacytosine Hydrate
- 4-Amino-1,3,5-triazin-2(1H)-one hydrate
- AKOS024377818
- 2-Amino-4-hydroxy-1,3,5-triazine hydrate
- 6-amino-1H-1,3,5-triazin-2-one;hydrate
-
- Inchi： 1S/C3H4N4O.H2O/c4-2-5-1-6-3(8)7-2;/h1H,(H3,4,5,6,7,8);1H2
- InChI Key： JYJVVKRYDFYVFN-UHFFFAOYSA-N
- SMILES： O=C1N=CN=C(N)N1.O
Computed Properties
- Exact Mass: 130.049
- Monoisotopic Mass: 130.049
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 170
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 80.8A^2
1,3,5-Triazin-2(1H)-one,6-amino-, hydrate (1:1) Related Literature
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
426837-12-9 (1,3,5-Triazin-2(1H)-one,6-amino-, hydrate (1:1)) Related Products
- 7313-54-4(Deisopropylhydroxyatrazine)
- 63166-37-0(1,3,5-Triazine-2,4(1H,3H)-dione, 6-amino-, sodium salt (1:1))
- 127480-39-1(1,3,5-Triazin-2(1H)-one,4-amino-1-methyl-6-(methylamino)-)
- 127480-12-0(1,3,5-Triazin-2(1H)-one,4,6-diamino-1-methyl-)
- 931-86-2(5-Azacytosine)
- 2492-97-9(1,3,5-Triazin-2(1H)-one)
- 2599-11-3(2-Hydroxysimazine)
- 914486-13-8(1,3,5-Triazin-2(1H)-one, 4-amino-6-(ethenylamino)-)
- 645-92-1(Ammeline)
- 645-93-2(Ammelide)
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