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1-Aminoindane hydrochloride

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Name

1-Aminoindane hydrochloride

EINECS 1312995-182-4
CAS No. 70146-15-5 Density 1.056 g/cm3
PSA 26.02000 LogP 3.13490
Solubility N/A Melting Point 206-210 °C
Formula C9H11N.HCl Boiling Point 225 °C at 760 mmHg
Molecular Weight 169.654 Flash Point 94.4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 70146-15-5 (1-Aminoindane hydrochloride) Hazard Symbols IrritantXi
Synonyms

1-Indanamine,hydrochloride (6CI,7CI);1H-Inden-1-amine, 2,3-dihydro-, hydrochloride (9CI);1-Aminoindan hydrochloride;NSC 186227;

Article Data 5

1-Aminoindane hydrochloride Specification

The 1H-Inden-1-amine,2,3-dihydro-, hydrochloride (1:1) is an organic compound with the formula C9H11N.HCl. The systematic name of this chemical is 2,3-dihydro-1H-inden-1-amine hydrochloride. With the CAS registry number 70146-15-5, it is also named as 1-Aminoindane hydrochloride. The product's category is APIs Intermediate. In addition, the molecular weight is 169.65.

The other characteristics of 1H-Inden-1-amine,2,3-dihydro-, hydrochloride (1:1) can be summarized as: (1)ACD/LogP: 1.61; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.44; (4)ACD/LogD (pH 7.4): -0.48; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1.45; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24 Å2; (13)Flash Point: 94.4 °C; (14)Enthalpy of Vaporization: 46.15 kJ/mol; (15)Boiling Point: 225 °C at 760 mmHg; (16)Vapour Pressure: 0.0886 mmHg at 25°C.

People can use the following data to convert to the molecule structure. 
1. SMILES:Cl.c1cccc2c1CCC2N
2. InChI:InChI=1/C9H11N.ClH/c10-9-6-5-7-3-1-2-4-8(7)9;/h1-4,9H,5-6,10H2;1H
3. InChIKey:RHAAGWRBIVCBSY-UHFFFAOYAX
4. Std. InChI:InChI=1S/C9H11N.ClH/c10-9-6-5-7-3-1-2-4-8(7)9;/h1-4,9H,5-6,10H2;1H 
5. Std. InChIKey:RHAAGWRBIVCBSY-UHFFFAOYSA-N

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