Dimethyl aminomalonate hydrochloride supplier

Name
DIMETHYL AMINOMALONATE HYDROCHLORIDE
EINECS 240-284-5
CAS No. 16115-80-3
Article Data2
CAS DataBase
Density 1.205g/cm³
Solubility
Melting Point 160 °C (dec.)(lit.)
Formula C₅H₁₀ClNO₄
Boiling Point 155.7 °C at 760 mmHg
Molecular Weight 183.592
Flash Point 33.2 °C
Transport Information
Appearance light yellow crystals or crystalline powder
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Malonicacid, amino-, dimethyl ester, hydrochloride (6CI,8CI);Propanedioic acid, amino-,dimethyl ester, hydrochloride (9CI);Aminomalonic acid dimethyl esterhydrochloride;Dimethyl aminomalonate hydrochloride;
PSA 78.62000
LogP 0.16200

Dimethyl aminomalonate hydrochloride Specification

The Propanedioic acid,2-amino-, 1,3-dimethyl ester, hydrochloride (1:1), with CAS registry number 16115-80-3, has the systematic name of dimethyl aminopropanedioate hydrochloride. This chemical is a kind of light yellow crystals or crystalline powder. And the chemical formula of this chemical is C₅H₁₀ClNO₄. What's more, its EINECS is 240-284-5.

Physical properties of Propanedioic acid,2-amino-, 1,3-dimethyl ester, hydrochloride (1:1): (1)ACD/LogP: -0.61; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.67; (4)ACD/LogD (pH 7.4): -0.61; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 9.76; (8)ACD/KOC (pH 7.4): 11.06; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 55.84 Å²; (13)Flash Point: 33.2 °C; (14)Enthalpy of Vaporization: 39.24 kJ/mol; (15)Boiling Point: 155.7 °C at 760 mmHg; (16)Vapour Pressure: 3 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Propanedioic acid,2-amino-, 1,3-dimethyl ester, hydrochloride (1:1) irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)C(N)C(=O)OC.Cl
(2)InChI: InChI=1/C5H9NO4.ClH/c1-9-4(7)3(6)5(8)10-2;/h3H,6H2,1-2H3;1H
(3)InChIKey: QWNDKNJSEWOEDM-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C5H9NO4.ClH/c1-9-4(7)3(6)5(8)10-2;/h3H,6H2,1-2H3;1H
(5)Std. InChIKey: QWNDKNJSEWOEDM-UHFFFAOYSA-N

Product Name

DIMETHYL AMINOMALONATE HYDROCHLORIDE

Dimethyl aminomalonate hydrochloride Specification

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