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1,4-Naphthalenediamine

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Name

1,4-Naphthalenediamine

EINECS 218-816-2
CAS No. 2243-61-0 Density 1.234 g/cm3
PSA 52.04000 LogP 3.16660
Solubility N/A Melting Point 114-116 °C
Formula C10H10N2 Boiling Point 369.6 °C at 760 mmHg
Molecular Weight 158.203 Flash Point 211.5 °C
Transport Information N/A Appearance N/A
Safety Risk Codes 22
Molecular Structure Molecular Structure of 2243-61-0 (1,4-DIAMINONAPHTHALENE) Hazard Symbols HarmfulXn
Synonyms

1,4-Diaminonaphthalene;Naphthalene-1,4-diamine;(4-amino-1-naphthyl)amine;1,4-Naphthylenediamine;1,4-Naphthalene diamine;

Article Data 46

1,4-Naphthalenediamine Specification

This chemical is called 1,4-Naphthalenediamine, and it can also be named as 1,4-Diaminonaphthalene. With the molecular formula of C10H10N2, its molecular weight is 158.2. The CAS registry number of this chemical is 2243-61-0, and its EINECS number is 218-816-2. 

Other characteristics of the 1,4-Naphthalenediamine can be summarised as follows: (1)ACD/LogP: 0.55; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.49; (4)ACD/LogD (pH 7.4): 0.55; (5)ACD/BCF (pH 5.5): 1.36; (6)ACD/BCF (pH 7.4): 1.53; (7)ACD/KOC (pH 5.5): 41.8; (8)ACD/KOC (pH 7.4): 47.19; (9)#H bond acceptors: 2; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 6.48 Å2; (13)Index of Refraction: 1.757; (14)Molar Refractivity: 52.56 cm3; (15)Molar Volume: 128.1 cm3; (16)Polarizability: 20.83×10-24 cm3; (17)Surface Tension: 64.3 dyne/cm; (18)Density: 1.234 g/cm3; (19)Flash Point: 211.5 °C; (20)Enthalpy of Vaporization: 61.64 kJ/mol; (21)Boiling Point: 369.6 °C at 760 mmHg; (22)Vapour Pressure: 1.17E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: c1cccc2c(ccc(N)c12)N
2.InChI: InChI=1/C10H10N2/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6H,11-12H2
3.InChIKey: OKBVMLGZPNDWJK-UHFFFAOYAN

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