Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
5-(Methylthio)-1H-tetrazole |
EINECS | N/A |
CAS No. | 29515-99-9 | Density | 1.48 g/cm3 |
PSA | 79.76000 | LogP | -0.07840 |
Solubility | N/A | Melting Point |
149-152 °C(lit.) |
Formula | C2H4N4S | Boiling Point | 293.8 °C at 760 mmHg |
Molecular Weight | 116.147 | Flash Point | 131.5 °C |
Transport Information | N/A | Appearance | White crystals |
Safety | 26-36-15 | Risk Codes | 36/37/38-5 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
1H-Tetrazole,5-(methylthio)- (8CI,9CI);Tetrazole, 5-(methylthio)- (6CI,7CI);5-(Methylthio)tetrazole;NSC 141852; |
Article Data | 10 |
Product Name: 5-(Methylthio)-1H-tetrazole (CAS NO.29515-99-9)
Molecular Formula: C2H4N4S
Molecular Weight: 116.14g/mol
Mol File: 29515-99-9.mol
Appearance: White crystals
Melting Point: 149-152 °C(lit.)
Boiling point: 293.8 °C at 760 mmHg
Storage Temperature: Store at 0-5°C
Flash Point: 131.5 °C
Density: 1.48 g/cm3
Index of Refraction: 1.599 Molar Refractivity: 26.71 cm3
Molar Volume: 78.1 cm3
Surface Tension: 95 dyne/cm
Enthalpy of Vaporization: 53.34 kJ/mol
Vapour Pressure: 0.00169 mmHg at 25°C
XLogP3-AA: 0.3
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of 5-(Methylthio)-1H-tetrazole (CAS NO.29515-99-9):
IUPAC Name: 5-methylsulfanyl-2H-tetrazole
Canonical SMILES: CSC1=NNN=N1
InChI: InChI=1S/C2H4N4S/c1-7-2-3-5-6-4-2/h1H3,(H,3,4,5,6)
InChIKey: ZBXNFTFKKOSPLD-UHFFFAOYSA-N
Product Categories: THIOL; Sulphur Derivatives; Building Blocks; Heterocyclic Building Blocks; Tetrazoles
Safety Information of 5-(Methylthio)-1H-tetrazole (CAS NO.29515-99-9):
Hazard Codes: Xi
Risk Statements: 36/37/38-5
R36/37/38:Irritating to eyes, respiratory system and skin.
R5:Heating may cause an explosion
Safety Statements: 26-36-15
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
S15:Keep away from heat.
WGK Germany: 3
5-(Methylthio)-1H-tetrazole , its CAS NO. is 29515-99-9, the synonyms are 5-Methylthiotetrazole ; 5-Thiomethyltetrazole ; 1H-Tetrazole, 5-(methylthio)- .