Bis(4-amino-2-chloro-3,5-diethylphenyl)methane supplier

Name
Bis(4-amino-2-chloro-3,5-diethylphenyl)methane
EINECS 1308068-626-2
CAS No. 106246-33-7
Article Data4
CAS DataBase
Density 1.154 g/cm³
Solubility 20μg/L at 20℃
Melting Point 87oC
Formula C₂₁H₂₈Cl₂N₂
Boiling Point 506.4 °C at 760 mmHg
Molecular Weight 379.373
Flash Point 260.1 °C
Transport Information
Appearance Crystalline Powder
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4,4'-Methylenebis(3-chloro-2,6-diethylaniline);C-BS 300;Lonzacure M-CDEA;Lonzacure M-CDEA-GS;
PSA 52.04000
LogP 7.16060

Bis(4-amino-2-chloro-3,5-diethylphenyl)methane Specification

The Benzenamine,4,4'-methylenebis[3-chloro-2,6-diethyl-, with CAS registry number 106246-33-7, has the systematic name of 4,4'-methanediylbis(3-chloro-2,6-diethylaniline). This chemical is a kind of crystalline powder. Its classification code is TSCA Flag P [A commenced PMN (Premanufacture Notice) substance].

Physical properties of Benzenamine,4,4'-methylenebis[3-chloro-2,6-diethyl-: (1)ACD/LogP: 7.36; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.36; (4)ACD/LogD (pH 7.4): 7.36; (5)ACD/BCF (pH 5.5): 228470.67; (6)ACD/BCF (pH 7.4): 232601.72; (7)ACD/KOC (pH 5.5): 237238.67; (8)ACD/KOC (pH 7.4): 241528.27; (9)#H bond acceptors: 2; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 6.48 Å²; (13)Index of Refraction: 1.597; (14)Molar Refractivity: 112.02 cm³; (15)Molar Volume: 328.5 cm³; (16)Polarizability: 44.41×10^-24cm³; (17)Surface Tension: 44.3 dyne/cm; (18)Density: 1.154 g/cm³; (19)Flash Point: 260.1 °C; (20)Enthalpy of Vaporization: 77.63 kJ/mol; (21)Boiling Point: 506.4 °C at 760 mmHg; (22)Vapour Pressure: 2.22E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1c(c(c(cc1Cc2cc(c(N)c(c2Cl)CC)CC)CC)N)CC
(2)InChI: InChI=1/C21H28Cl2N2/c1-5-12-9-14(18(22)16(7-3)20(12)24)11-15-10-13(6-2)21(25)17(8-4)19(15)23/h9-10H,5-8,11,24-25H2,1-4H3
(3)InChIKey: VIOMIGLBMQVNLY-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C21H28Cl2N2/c1-5-12-9-14(18(22)16(7-3)20(12)24)11-15-10-13(6-2)21(25)17(8-4)19(15)23/h9-10H,5-8,11,24-25H2,1-4H3
(5)Std. InChIKey: VIOMIGLBMQVNLY-UHFFFAOYSA-N

Product Name

Bis(4-amino-2-chloro-3,5-diethylphenyl)methane

Bis(4-amino-2-chloro-3,5-diethylphenyl)methane Specification

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