Phenol,3,3'-methylenebis[6-amino- supplier

Name
3,3'-Dihydroxy-4,4'-diaminodiphenylmethane
EINECS
CAS No. 22428-30-4
Article Data3
CAS DataBase
Density 1.352 g/cm³
Solubility
Melting Point
Formula C₁₃H₁₄N₂O₂
Boiling Point 462.8 °C at 760 mmHg
Molecular Weight 230.266
Flash Point 233.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4,4'-Diamino-3,3'-dihydroxydiphenylmethane;3,3'-Dihydroxy-4,4'-diaminodiphenylmethane;3,3'-Methanediylbis(6-aminophenol);
PSA 92.50000
LogP 3.01540

Phenol,3,3'-methylenebis[6-amino- Specification

The Phenol,3,3'-methylenebis[6-amino-, with the CAS registry number 22428-30-4, is also known as 3,3'-Dihydroxy-4,4'-diaminodiphenylmethane. This chemical's molecular formula is C₁₃H₁₄N₂O₂ and molecular weight is 230.26. What's more, its systematic name is 3,3'-Methanediylbis(6-aminophenol).

Physical properties of Phenol,3,3'-methylenebis[6-amino- are: (1)ACD/LogP: 0.65; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 0.28; (4)ACD/LogD (pH 7.4): 0.63; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1.76; (7)ACD/KOC (pH 5.5): 23.1; (8)ACD/KOC (pH 7.4): 51.51; (9)#H bond acceptors: 4; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 24.94 Å²; (13)Index of Refraction: 1.727; (14)Molar Refractivity: 67.8 cm³; (15)Molar Volume: 170.2 cm³; (16)Polarizability: 26.87×10^-24cm³; (17)Surface Tension: 74.3 dyne/cm; (18)Density: 1.352 g/cm³; (19)Flash Point: 233.7 °C; (20)Enthalpy of Vaporization: 75.17 kJ/mol; (21)Boiling Point: 462.8 °C at 760 mmHg; (22)Vapour Pressure: 3.46E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C=C1CC2=CC(=C(C=C2)N)O)O)N
(2)InChI: InChI=1S/C13H14N2O2/c14-10-3-1-8(6-12(10)16)5-9-2-4-11(15)13(17)7-9/h1-4,6-7,16-17H,5,14-15H2
(3)InChIKey: RCYNJDVUURMJOZ-UHFFFAOYSA-N

Product Name

3,3'-Dihydroxy-4,4'-diaminodiphenylmethane

Phenol,3,3'-methylenebis[6-amino- Specification

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