1H-Indole-1-carbonylchloride, 2,3-dihydro- supplier

Name
1H-Indole-1-carbonyl chloride, 2,3-dihydro- (9CI)
EINECS
CAS No. 117086-91-6
Article Data7
CAS DataBase
Density 1.338 g/cm³
Solubility
Melting Point
Formula C₉H₈ClNO
Boiling Point 325.246 °C at 760 mmHg
Molecular Weight 181.622
Flash Point 150.504 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms MolPort-004-762-043;
PSA 20.31000
LogP 2.47290

1H-Indole-1-carbonylchloride, 2,3-dihydro- Specification

The 1H-Indole-1-carbonylchloride, 2,3-dihydro-, with the CAS registry number 117086-91-6, is also known as MolPort-004-762-043. It belongs to the product category of Acidhalide. This chemical's molecular formula is C₉H₈ClNO and molecular weight is 181.61892. Its IUPAC name is called 2,3-dihydroindole-1-carbonyl chloride.

Physical properties of 1H-Indole-1-carbonylchloride, 2,3-dihydro-: (1)ACD/LogP: 1.39; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 20; (5)ACD/BCF (pH 7.4): 20; (6)ACD/KOC (pH 5.5): 294; (7)ACD/KOC (pH 7.4): 294; (8)#H bond acceptors: 2; (9)Index of Refraction: 1.606; (10)Molar Refractivity: 46.803 cm³; (11)Molar Volume: 135.715 cm³; (12)Surface Tension: 51.152 dyne/cm; (13)Density: 1.338 g/cm³; (14)Flash Point: 150.504 °C; (15)Enthalpy of Vaporization: 56.735 kJ/mol; (16)Boiling Point: 325.246 °C at 760 mmHg; (17)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CN(C2=CC=CC=C21)C(=O)Cl
(2)InChI: InChI=1S/C9H8ClNO/c10-9(12)11-6-5-7-3-1-2-4-8(7)11/h1-4H,5-6H2
(3)InChIKey: BHVDNQHSQZMQMJ-UHFFFAOYSA-N

Product Name

1H-Indole-1-carbonyl chloride, 2,3-dihydro- (9CI)

1H-Indole-1-carbonylchloride, 2,3-dihydro- Specification

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