2,5-Dibromo-3-decylthiophene supplier

Name
2,5-Dibromo-3-decylthiophene
EINECS
CAS No. 158956-23-1
Article Data2
CAS DataBase
Density 1.384 g/cm³
Solubility
Melting Point
Formula C₁₄H₂₂Br₂S
Boiling Point 378.3 °C at 760 mmHg
Molecular Weight 382.203
Flash Point 182.6 °C
Transport Information
Appearance
Safety 26
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Thiophene, 2,5-dibromo-3-decyl-;
PSA 28.24000
LogP 6.95630

2,5-Dibromo-3-decylthiophene Specification

The CAS register number of 2,5-Dibromo-3-decylthiophene is 158956-23-1. It also can be called as Thiophene, 2,5-dibromo-3-decyl- and the IUPAC name about this chemical is 2,5-dibromo-3-decylthiophene. The molecular formula about this chemical is C₁₄H₂₂Br₂S and molecular weight is 382.20. It belongs to the following product categories which include Organic Electronics and Photonics; Synthetic Tools and Reagents; Thiophene Monomers and Building Blocks; Thiophenes and so on.

Physical properties about 2,5-Dibromo-3-decylthiophene are: (1)ACD/LogP: 8.80; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.8; (4)ACD/LogD (pH 7.4): 8.8; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 1450955.13; (8)ACD/KOC (pH 7.4): 1450955.13; (9)#Freely Rotating Bonds: 9; (10)Polar Surface Area: 28.24Å²; (11)Index of Refraction: 1.539; (12)Molar Refractivity: 86.62 cm³; (13)Molar Volume: 276.1 cm³; (14)Polarizability: 34.34x10^-24cm³; (15)Surface Tension: 38.1 dyne/cm; (16)Enthalpy of Vaporization: 60.16 kJ/mol; (17)Boiling Point: 378.3 °C at 760 mmHg; (18)Vapour Pressure: 1.38E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1sc(Br)cc1CCCCCCCCCC
(2)InChI: InChI=1/C14H22Br2S/c1-2-3-4-5-6-7-8-9-10-12-11-13(15)17-14(12)16/h11H,2-10H2,1H3
(3)InChIKey: CQDSRZZKSUNTSB-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C14H22Br2S/c1-2-3-4-5-6-7-8-9-10-12-11-13(15)17-14(12)16/h11H,2-10H2,1H3
(5)Std. InChIKey: CQDSRZZKSUNTSB-UHFFFAOYSA-N

Product Name

2,5-Dibromo-3-decylthiophene

2,5-Dibromo-3-decylthiophene Specification

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