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5978-75-6

Basic Information
CAS No.: 5978-75-6
Name: 9-Aminofluorene hydrochloride
Article Data: 3
Molecular Structure:
Molecular Structure of 5978-75-6 (9-Aminofluorene hydrochloride)
Formula: C13H12ClN
Molecular Weight: 217.698
Synonyms: 9H-Fluoren-9-amine,hydrochloride (9CI);Fluoren-9-amine, hydrochloride (8CI);9-Aminofluorenehydrochloride;9-Fluorenylamine hydrochloride;
EINECS: 227-778-6
Melting Point: 265-270 °C(lit.)
Boiling Point: 331.1 °C at 760 mmHg
Flash Point: 168.1 °C
Appearance: White to beige crystalline powder
Risk Codes: 36/37/38
Safety: 24/25
PSA: 26.02000
LogP: 4.21740
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Specification

The 9H-Fluoren-9-amine, hydrochloride (1:1), with the CAS registry number 5978-75-6, is also known as 9-Aminofluorenehydrochloride. Its EINECS number is 227-778-6 and its systematic name is 9H-Fluoren-9-amine hydrochloride. This chemical's molecular formula is C13H12ClN and molecular weight is 217.69. What's more, it belongs to the product categories of Fluorenes; Fluorenes & Fluorenones. It is irritating to eyes, respiratory system and skin. When using it, you need avoid contact with skin and eyes. 

Physical properties of 9H-Fluoren-9-amine,hydrochloride (1:1) are: (1)ACD/LogP: 2.70; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.03; (4)ACD/LogD (pH 7.4): 1.69; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 6.56; (7)ACD/KOC (pH 5.5): 1.52; (8)ACD/KOC (pH 7.4): 69.43; (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: 168.1 °C; (14)Enthalpy of Vaporization: 57.37 kJ/mol; (15)Boiling Point: 331.1 °C at 760 mmHg; (16)Vapour Pressure: 0.000159 mmHg at 25°C.

Uses of 9H-Fluoren-9-amine, hydrochloride (1:1): it can be used to produce N-(9-Fluorenyl)-2,5-anhydro-2,5-imino-D-glucitol by heating. It will need reagent NaBH3CN and solvent methanol with the reaction time of 24 hours. The yield is about 33%.

9H-Fluoren-9-amine, hydrochloride can be used to produce N-(9-Fluorenyl)-2,5-anhydro-2,5-imino-D-glucitol by heating

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)N.Cl
(2)InChI: InChI=1S/C13H11N.ClH/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13;/h1-8,13H,14H2;1H
(3)InChIKey: SYKJOJSYQSVNOM-UHFFFAOYSA-N