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Melamine Cyanurate
CAS: 37640-57-6 | C6H9N9O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
37640-57-6
Molecular Formula:
C6H9N9O3
Molecular Mass:
255.20 g/mol
Names and Synonyms:
Melamine Cyanurate
1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, compd. with 1,3,5-triazine-2,4,6-triamine (1:1)
FT 6120MC15
MCA 55
Nonfla MC 600
MCA 55 (cyanurate)
MCA 300
Stabiace MC 3S
XS-MC 1
Phoslite B 65AM
MC 20S
Melapur MC 15ED
MCA 210
MC 602
MC 3000
Rilsan MB 3000
HT 211
MCA 19
FR 106
MP
Haida FR 106
SunFla MC 100
XS-MC 15
MCA 10
Melapur 25
MCA 510
JLS-MC 25
XS-MC 151
JLS-MCA
MCA 301
MC 12
JSL-MC 15
Mastertek 374115
MCA 152
FCC-MC 03
Aflammit PMN 525
MCA 410
MCA 151
1,3,5-Triazine-2,4,6-triamine, compd. with 1,3,5-triazine-2,4,6(1H,3H,5H)-trione (1:1)
Melamine cyanurate
Melamine cyanurate (1:1)
Melamine-isocyanuric acid compd.
Melamine-cyanuric acid compd.
D 022
Melamine isocyanurate
MX
Mitec MX 601
MCA
MX 601
DHF 100
MC 101 (cyanurate)
MC 101
MC 600
Fyrol MC
MC White
MC 610
MC 490
MX 44
MC 410
MC 690
Plastisan B
Melapur MC 25
MC 25
MC 50
C 1
MC 1
MC 1 (cyanurate)
Budit 315
Melapur MC
MC 640
MCA-CO
Melapur MC 50
MCA-C 1
MCA-COP
Budit 314
NSC 231587
Melapur MC 15
MC 15
FR 6120
MC 810
MC 810 (fireproofing agent)
Melamine isocyanurate (1:1)
NC 600
MC-C 0
Melapur 50
Melagard MC 25
Nord-Min MC 25J
MC 6000
MCA-C 0
MC 4000
JLS-MC 810D
MC 5F
Stabiace MC 5S
Flameproof MC-M
MCA 15
Stabiace MC 5F
JLS-MC 810
Melagard MC 8
Budit 315E
MC 5S
Stabiace MC 2010N
MC 2010N
MC 4500
MCA 12
CG 610
MCA 25
MC 20SJ
MC 1100
CG 615
MCA 033
Exflam MCA
Melanic MC
Identifiers:
SMILES:
N=c1[nH]c(=N)[nH]c(=N)[nH]1.Oc1nc(O)nc(O)n1
InChI:
InChI=1S/C3H6N6.C3H3N3O3/c4-1-7-2(5)9-3(6)8-1;7-1-4-2(8)6-3(9)5-1/h(H6,4,5,6,7,8,9);(H3,4,5,6,7,8,9)
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 255.20 g/mol | CAS Common Chemistry |
| 255.19800000000004 g/mol | RDKit | |
| 255.082835148 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Melamine_cyanurate | CAS Common Chemistry |
| Canonical SMILES | O=C1NC(=O)NC(=O)N1.N=1C(=NC(=NC1N)N)N | CAS Common Chemistry |
| InChI | InChI=1S/C3H6N6.C3H3N3O3/c4-1-7-2(5)9-3(6)8-1;7-1-4-2(8)6-3(9)5-1/h(H6,4,5,6,7,8,9);(H3,4,5,6,7,8,9) | CAS Common Chemistry |
| InChI Key | InChIKey=ZQKXQUJXLSSJCH-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Melamine cyanurate | CAS Common Chemistry |
| Heavy Atom Count | 18 | RDKit |
| Hydrogen Bond Acceptors | 9 | RDKit |
| Hydrogen Bond Donors | 9 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 218.27999999999997 Ų | RDKit |
| LogP | -2.9022900000000007 | RDKit |
| Molar Refractivity | 51.879599999999996 | RDKit |
