The 1,2-Benzenediamine,4-methoxy-, hydrochloride (1:2), with the CAS registry number 59548-39-9, is also known as 3,4-Diaminoanisole dihydrochloride. Its EINECS number is 261-801-0. This chemical's molecular formula is C7H12Cl2N2O and molecular weight is 211.09. What's more, its IUPAC name is 4-methoxybenzene-1,2-diamine dihydrochloride.
Physical properties of 1,2-Benzenediamine,4-methoxy-, hydrochloride (1:2) are: (1)ACD/LogP: -0.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.24; (4)ACD/LogD (pH 7.4): -0.16; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 16.32; (8)ACD/KOC (pH 7.4): 19.53; (9)#H bond acceptors: 3; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 3; (12)Flash Point: 161.7 °C; (13)Enthalpy of Vaporization: 54.26 kJ/mol; (14)Boiling Point: 302.4 °C at 760 mmHg; (15)Vapour Pressure: 0.000994 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.Cl.O(c1ccc(c(N)c1)N)C
(2)Std. InChI: InChI=1S/C7H10N2O.2ClH/c1-10-5-2-3-6(8)7(9)4-5;;/h2-4H,8-9H2,1H3;2*1H
(3)Std. InChIKey: SXCHMHOBHJOXGC-UHFFFAOYSA-N
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View