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CAS No.: | 123266-63-7 |
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Name: | 2,3-DIHYDRO-1-BENZOFURAN-7-CARBONYL CHLORIDE |
Article Data: | 13 |
Molecular Structure: | |
Formula: | C9H7ClO2 |
Molecular Weight: | 182.606 |
Synonyms: | 2,3-Dihydrobenzofuran-7-carbonylchloride; |
Density: | 1.342 g/cm3 |
Boiling Point: | 299.8 °C at 760 mmHg |
Flash Point: | 111.6 °C |
Hazard Symbols: | C |
Risk Codes: | C:Corrosive; "> C:Corrosive; |
PSA: | 26.30000 |
LogP: | 2.00050 |
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The 7-Benzofurancarbonylchloride, 2, 3-dihydro-, with the CAS registry number of 123266-63-7, is also known as 2, 3-Dihydrobenzo[b]furan-7-carbonyl chloride. It belongs to the product category of Acidhalide. This chemical's molecular formula is C9H7ClO2 and molecular weight is 182.6037. What's more, its systematic name is called 2, 3-Dihydro-1-benzofuran-7-carbonyl chloride. Besides, this chemical may destroy living tissue on contact.
Physical properties about 7-Benzofurancarbonylchloride, 2, 3-dihydro- are: (1)ACD/LogP: 1.95; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.95; (4)ACD/LogD (pH 7.4): 1.95; (5)ACD/BCF (pH 5.5): 17.75; (6)ACD/BCF (pH 7.4): 17.75; (7)ACD/KOC (pH 5.5): 272.73; (8)ACD/KOC (pH 7.4): 272.73; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.586; (14)Molar Refractivity: 45.66 cm3; (15)Molar Volume: 135.9 cm3; (16)Surface Tension: 50.1 dyne/cm; (17)Density: 1.342 g/cm3; (18)Flash Point: 111.6 °C; (19)Enthalpy of Vaporization: 53.98 kJ/mol; (20)Boiling Point: 299.8 °C at 760 mmHg; (21)Vapour Pressure: 0.00116 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: ClC(=O)c2cccc1c2OCC1
(2) InChI: InChI=1/C9H7ClO2/c10-9(11)7-3-1-2-6-4-5-12-8(6)7/h1-3H,4-5H2
(3) InChIKey: KNBGUBMIJPZGHF-UHFFFAOYAF