Basic Information | Post buying leads | Suppliers |
Name |
Methyl 1-aminomethyl-cyclohexanecarboxylate HCl |
EINECS | N/A |
CAS No. | 227203-36-3 | Density | N/A |
PSA | 52.32000 | LogP | 2.57090 |
Solubility | N/A | Melting Point |
169-170 ° C |
Formula | C9H18ClNO2 | Boiling Point | 273.4 °C at 760 mmHg |
Molecular Weight | 207.70 | Flash Point | 119.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Cyclohexanecarboxylicacid, 1-(aminomethyl)-, methyl ester, hydrochloride (9CI);Methyl 1-(aminomethyl)cyclohexanecarboxylate hydrochloride (1:1); |
The Cyclohexanecarboxylicacid, 1-(aminomethyl)-, methyl ester, hydrochloride (1:1), with CAS registry number 227203-36-3, has the systematic name of methyl 1-(aminomethyl)cyclohexane-1-carboxylate hydrochloride. Besides this, it is also called Methyl 1-aminomethyl-cyclohexanecarboxylate hcl. And the chemical formula of this chemical is C9H18ClNO2.
Physical properties of Cyclohexanecarboxylicacid, 1-(aminomethyl)-, methyl ester, hydrochloride (1:1): (1)ACD/LogP: 1.30; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 52.32 Å2; (7)Flash Point: 119.1 °C; (8)Enthalpy of Vaporization: 52.2 kJ/mol; (9)Boiling Point: 273.4 °C at 760 mmHg; (10)Vapour Pressure: 0.00446 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.NCC1(CCCCC1)C(=O)OC
(2)InChI: InChI=1/C9H17NO2.ClH/c1-12-8(11)9(7-10)5-3-2-4-6-9;/h2-7,10H2,1H3;1H
(3)InChIKey: MJTJGUAHTHRKHJ-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C9H17NO2.ClH/c1-12-8(11)9(7-10)5-3-2-4-6-9;/h2-7,10H2,1H3;1H
(5)Std. InChIKey: MJTJGUAHTHRKHJ-UHFFFAOYSA-N