Ethanol,2-[(3-methylphenyl)amino]- supplier

Name
N-2-HYDROXYETHYL-M-TOLUIDINE
EINECS 203-029-9
CAS No. 102-41-0
Article Data15
CAS DataBase
Density 1.086 g/cm³
Solubility
Melting Point
Formula C₉H₁₃NO
Boiling Point 302.5 °C at 760 mmHg
Molecular Weight 151.208
Flash Point 146.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Ethanol,2-m-toluidino- (6CI,7CI,8CI);2-[(3-Methylphenyl)amino]ethanol;2-m-Toluidinoethanol;2-m-Tolylaminoethanol;N-(2-Hydroxyethyl)-3-methylaniline;N-(2-Hydroxyethyl)-m-toluidine;N-(3-Methylphenyl)ethanolamine;N-(b-Hydroxyethyl)-m-toluidine;N-3-Tolylethanolamine;N-Monohydroxyethyl-m-toluidine;N-b-Hydroxyethyl-3-methylaniline;NSC 2153;m-Tolylethanolamine;
PSA 32.26000
LogP 1.47220

Ethanol,2-[(3-methylphenyl)amino]- Specification

The IUPAC name of Ethanol,2-[(3-methylphenyl)amino]- is 2-(3-methylanilino)ethanol. With the CAS registry number 102-41-0, it is also named as 2-m-Toluidinoethanol. In addition, its molecular formula is C₉H₁₃NO and its molecular weight is 151.20562.

The other characteristics of Ethanol,2-[(3-methylphenyl)amino]- can be summarized as: (1)EINECS: 203-029-9; (2)ACD/LogP: 1.28; (3)# of Rule of 5 Violations: 0; (4)ACD/LogD (pH 5.5): 1.23; (5)ACD/LogD (pH 7.4): 1.28; (6)ACD/BCF (pH 5.5): 4.91; (7)ACD/BCF (pH 7.4): 5.52; (8)ACD/KOC (pH 5.5): 105.11; (9)ACD/KOC (pH 7.4): 118.21; (10)#H bond acceptors: 2; (11)#H bond donors: 2; (12)#Freely Rotating Bonds: 4; (13)Polar Surface Area: 12.47 Å²; (14)Index of Refraction: 1.588; (15)Molar Refractivity: 46.85 cm³; (16)Molar Volume: 139.1 cm³; (17)Polarizability: 18.57×10^-24cm³; (18)Surface Tension: 44.9 dyne/cm; (19)Density: 1.086 g/cm³; (20)Flash Point: 146.6 °C; (21)Enthalpy of Vaporization: 57.31 kJ/mol; (22)Boiling Point: 302.5 °C at 760 mmHg; (23)Vapour Pressure: 0.000434 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: OCCNc1cc(ccc1)C
(2)InChI: InChI=1/C9H13NO/c1-8-3-2-4-9(7-8)10-5-6-11/h2-4,7,10-11H,5-6H2,1H3
(3)InChIKey: GZCPEUOCUUNCLZ-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C9H13NO/c1-8-3-2-4-9(7-8)10-5-6-11/h2-4,7,10-11H,5-6H2,1H3
(5)Std. InChIKey: GZCPEUOCUUNCLZ-UHFFFAOYSA-N

Product Name

N-2-HYDROXYETHYL-M-TOLUIDINE

Ethanol,2-[(3-methylphenyl)amino]- Specification

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