CAS No.28735-21-9,3-Methylthio-1,2,4-triazine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	28735-21-9
Name:	3-Methylthio-1,2,4-triazine
Article Data:	12

Formula:	C₄H₅N₃S
Molecular Weight:	127.17
Synonyms:	3-Methylthio-1,2,4-triazine;NSC 276290;
Density:	1.287 g/cm³
Melting Point:	33 °C
Boiling Point:	275.754 °C at 760 mmHg
Flash Point:	120.572 °C
Hazard Symbols:	Xn
Risk Codes:	22
PSA:	63.97000
LogP:	0.59350

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Specification

The 3-Methylthio-1,2,4-triazine is an organic compound with the formula C₄H₅N₃S. The IUPAC name of this chemical is 3-methylsulfanyl-1,2,4-triazine. With the CAS registry number 28735-21-9, it is also named as 3-(Methylsulfanyl)-1,2,4-triazine.

Physical properties about 3-Methylthio-1,2,4-triazine are: (1)ACD/LogP: -0.03; (2)#H bond acceptors: 3; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 63.97 Å²; (5)Index of Refraction: 1.577; (6)Molar Refractivity: 32.78 cm³; (7)Molar Volume: 98.8 cm³; (8)Polarizability: 12.99×10^-24cm³; (9)Surface Tension: 66.9 dyne/cm; (10)Density: 1.28 g/cm³; (11)Flash Point: 120.6 °C; (12)Enthalpy of Vaporization: 49.35 kJ/mol; (13)Boiling Point: 275.8 °C at 760 mmHg; (14)Vapour Pressure: 0.0084 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: S(c1nccnn1)C
(2)InChI: InChI=1/C4H5N3S/c1-8-4-5-2-3-6-7-4/h2-3H,1H3
(3)InChIKey: NFHGWQLAJYTULJ-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C4H5N3S/c1-8-4-5-2-3-6-7-4/h2-3H,1H3
(5)Std. InChIKey: NFHGWQLAJYTULJ-UHFFFAOYSA-N