Methyl indoline-5-carboxylate supplier

Name
methyl indoline-5-carboxylate
EINECS
CAS No. 141452-01-9
Article Data22
CAS DataBase
Density 1.162 g/cm³
Solubility
Melting Point 67-69 °C
Formula C₁₀H₁₁NO₂
Boiling Point 330.955 °C at 760 mmHg
Molecular Weight 177.203
Flash Point 153.956 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Methyl2,3-dihydro-1H-indole-5-carboxylate;
PSA 38.33000
LogP 1.57920

Methyl indoline-5-carboxylate Specification

This chemical is called Methyl 2,3-dihydro-1H-indole-5-carboxylate, and its CAS registry number is 141452-01-9. With the molecular formula of C₁₀H₁₁NO₂, its molecular weight is 177.20.

Other characteristics of the Methyl 2,3-dihydro-1H-indole-5-carboxylate can be summarised as followings: (1)ACD/LogP: 2.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 28; (6)ACD/BCF (pH 7.4): 28; (7)ACD/KOC (pH 5.5): 373; (8)ACD/KOC (pH 7.4): 374; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 38.33 Å²; (13)Index of Refraction: 1.555; (14)Molar Refractivity: 48.937 cm³; (15)Molar Volume: 152.45 cm³; (16)Polarizability: 19.4×10^-24cm³; (17)Surface Tension: 43.323 dyne/cm; (18)Density: 1.162 g/cm³; (19)Flash Point: 153.956 °C; (20)Enthalpy of Vaporization: 57.358 kJ/mol; (21)Boiling Point: 330.955 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: COC(=O)c1cc2CCNc2cc1
2.InChI: InChI=1/C10H11NO2/c1-13-10(12)8-2-3-9-7(6-8)4-5-11-9/h2-3,6,11H,4-5H2,1H3
3.InChIKey: VVAPQJBMJBCZMH-UHFFFAOYAC

Product Name

methyl indoline-5-carboxylate

Methyl indoline-5-carboxylate Specification

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