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1H-inden-1-amine, 5-chloro-2,3-dihydro- (67120-39-2)

Identification
Name:1H-inden-1-amine, 5-chloro-2,3-dihydro-
Synonyms:5-Chloro-1-indanylamine;
CAS:67120-39-2
Molecular Formula: C9H10ClN
Molecular Weight: 167.64
InChI: InChI=1/C9H10ClN/c10-7-2-3-8-6(5-7)1-4-9(8)11/h2-3,5,9H,1,4,11H2
Molecular Structure: (C9H10ClN) 5-Chloro-1-indanylamine;
Properties
Density:1.214 g/cm3
Refractive index:1.595
Specification:

The 5-Chloroindan-1-amine is an organic compound with the formula C9H10ClN. The systematic name of this chemical is 5-chloro-2,3-dihydro-1H-inden-1-amine. With the CAS registry number 67120-39-2, it is also named as 1H-inden-1-amine, 5-chloro-2,3-dihydro-. In addition, this chemical must be stored at normal temperature and avoid direct sunshine.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 2.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 5; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.595; (12)Molar Refractivity: 46.875 cm3; (13)Molar Volume: 138.046 cm3; (14)Polarizability: 18.583×10-24 cm3; (15)Surface Tension: 45.851 dyne/cm; (16)Density: 1.214 g/cm3; (17)Flash Point: 112.839 °C; (18)Enthalpy of Vaporization: 50.078 kJ/mol; (19)Boiling Point: 262.968 °C at 760 mmHg; (20)Vapour Pressure: 0.011 mmHg at 25°C.

People can use the following data to convert to the molecule structure.
1. SMILES: Clc1cc2CCC(N)c2cc1;
2. InChI: InChI=1/C9H10ClN/c10-7-2-3-8-6(5-7)1-4-9(8)11/h2-3,5,9H,1,4,11H2;
3. InChIKey: CCNOGOGUHOMLMI-UHFFFAOYAS.

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