Basic Information | Post buying leads | Suppliers |
Name |
1,2,3-Thiadiazole,4-[4-(bromomethyl)phenyl]- |
EINECS | N/A |
CAS No. | 163798-92-3 | Density | 1.593 g/cm3 |
PSA | 54.02000 | LogP | 3.10000 |
Solubility | N/A | Melting Point |
135 °C |
Formula | C9H7BrN2S | Boiling Point | 362.6 °C at 760 mmHg |
Molecular Weight | 255.13 | Flash Point | 173.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
4-(1,2,3-Thiadiazol-4-yl)benzylbromide;4-(4-Bromomethylphenyl)-1,2,3-thiadiazole; |
The 1,2,3-Thiadiazole,4-[4-(bromomethyl)phenyl]- is an organic compound with the formula C9H7BrN2S. The systematic name of this chemical is 4-[4-(Bromomethyl)phenyl]-1,2,3-thiadiazole. With the CAS registry number 163798-92-3, it is also named as 4-(1,2,3-Thiadiazol-4-yl)benzyl bromide. Besides, its molecular weight is 255.1343.
Physical properties about 1,2,3-Thiadiazole,4-[4-(bromomethyl)phenyl]- are: (1)ACD/LogP: 3.25; (2)ACD/LogD (pH 5.5): 3.25; (3)ACD/LogD (pH 7.4): 3.25; (4)ACD/BCF (pH 5.5): 173.04; (5)ACD/BCF (pH 7.4): 173.04; (6)ACD/KOC (pH 5.5): 1392.12; (7)ACD/KOC (pH 7.4): 1392.12; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 54.02 Å2; (11)Index of Refraction: 1.645; (12)Molar Refractivity: 58.05 cm3; (13)Molar Volume: 160.1 cm3; (14)Polarizability: 23.01×10-24 cm3; (15)Surface Tension: 57.5 dyne/cm; (16)Density: 1.593 g/cm3; (17)Flash Point: 173.1 °C; (18)Enthalpy of Vaporization: 58.46 kJ/mol; (19)Boiling Point: 362.6 °C at 760 mmHg; (20)Vapour Pressure: 3.99E-05 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C9H7BrN2S/c10-5-7-1-3-8(4-2-7)9-6-13-12-11-9/h1-4,6H,5H2
(2)InChIKey: DGHQOPZIGDRUIT-UHFFFAOYAM
(3)Std. InChI: InChI=1S/C9H7BrN2S/c10-5-7-1-3-8(4-2-7)9-6-13-12-11-9/h1-4,6H,5H2
(4)Std. InChIKey: DGHQOPZIGDRUIT-UHFFFAOYSA-N