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18836-29-8

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Basic Information
CAS No.: 18836-29-8
Name: HYDRAZINE CYANURATE
Molecular Structure:
Molecular Structure of 18836-29-8 (HYDRAZINE CYANURATE)
Formula: C3H7N5O3
Molecular Weight: 161.12
Synonyms: 1,3,5-Triazine-2,4,6-triol - hydrazine (1:1);
EINECS: 242-618-5
Boiling Point: 816.6 °C at 760 mmHg
Flash Point: 447.7 °C
Appearance: UN 2811 6.1/PG 2
Hazard Symbols: ToxicT
Risk Codes: 23/24/25
Safety: 36/37/39-45
PSA: 151.40000
LogP: -0.79220
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Specification

The 1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, compound with hydrazine (1:1) has the CAS registry number 18836-29-8. It belongs to the product categories of Heterocyclic Compounds; Building Blocks; Heterocyclic Building Blocks; Triazines. Its EINECS number is 242-618-5. This chemical's molecular formula is C3H7N5O3 and molecular weight is 161.12. What's more, its systematic name is 1,3,5-triazine-2,4,6-triol - hydrazine (1:1).

Physical properties of 1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, compound with hydrazine (1:1) are: (1)# of Rule of 5 Violations: 1; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 8; (7)#H bond donors: 7; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 151.4 Å2; (10)Flash Point: 447.7 °C; (11)Enthalpy of Vaporization: 122.8 kJ/mol; (12)Boiling Point: 816.6 °C at 760 mmHg; (13)Vapour Pressure: 8.7E-28 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is toxic by inhalation, in contact with skin and if swallowed. When using it, you need wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell, you must seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1nc(O)nc(O)n1.NN
(2)Std. InChI: InChI=1S/C3H3N3O3.H4N2/c7-1-4-2(8)6-3(9)5-1;1-2/h(H3,4,5,6,7,8,9);1-2H2
(3)Std. InChIKey: REWJAYUHYGWDJT-UHFFFAOYSA-N