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Ethyl 4-(methylamino)piperidine-1-carboxylate

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Name

Ethyl 4-(methylamino)piperidine-1-carboxylate

EINECS N/A
CAS No. 73733-69-4 Density 1.051 g/cm3
PSA 41.57000 LogP 1.15550
Solubility N/A Melting Point ~25?°C
Formula C9H18N2O2 Boiling Point 267.431 °C at 760 mmHg
Molecular Weight 186.25 Flash Point 115.538 °C
Transport Information N/A Appearance N/A
Safety Risk Codes R20
Molecular Structure Molecular Structure of 73733-69-4 (1-CARBETHOXY-4-(METHYLAMINO)PIPERIDINE) Hazard Symbols Xn,Xi
Synonyms

Ethyl4-(methylamino)-1-piperidinecarboxylate;T 1405;

Article Data 6

Ethyl 4-(methylamino)piperidine-1-carboxylate Specification

This chemical is called 1-Piperidinecarboxylicacid, 4-(methylamino)-, ethyl ester, and its systematic name is Ethyl 4-(methylamino)piperidine-1-carboxylate. With the molecular formula of C9H18N2O2, its molecular weight is 186.25. The CAS registry number of this chemical is 73733-69-4. Additionally, its product category is Piperidine.

Other characteristics of the 1-Piperidinecarboxylicacid, 4-(methylamino)-, ethyl ester can be summarised as followings: (1)ACD/LogP: 0.62; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3; (4)ACD/LogD (pH 7.4): -2; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 41.57 Å2; (13)Index of Refraction: 1.488; (14)Molar Refractivity: 51.038 cm3; (15)Molar Volume: 177.212 cm3; (16)Polarizability: 20.233×10-24cm3; (17)Surface Tension: 37.646 dyne/cm; (18)Density: 1.051 g/cm3; (19)Flash Point: 115.538 °C; (20)Enthalpy of Vaporization: 50.546 kJ/mol; (21)Boiling Point: 267.431 °C at 760 mmHg; (22)Vapour Pressure: 0.008 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OCC)N1CCC(NC)CC1
2.InChI: InChI=1/C9H18N2O2/c1-3-13-9(12)11-6-4-8(10-2)5-7-11/h8,10H,3-7H2,1-2H3
3.InChIKey: QKPLFXBOWHKIQH-UHFFFAOYAC

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