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5787-71-3

Basic Information
CAS No.: 5787-71-3
Name: GIRARD'S REAGENT D
Molecular Structure:
Molecular Structure of 5787-71-3 (GIRARD'S REAGENT D)
Formula: C4H13Cl2N3O
Molecular Weight: 190.073
Synonyms: Girard's reagent D;Hydrazinecarbonylmethyl-dimethyl-azanium;
EINECS: 208-721-4
Melting Point: 208-212 °C
Boiling Point: 256.1 °C at 760 mmHg
Flash Point: 108.7 °C
Solubility: almost transparency
Appearance: white fine crystalline powder
Hazard Symbols: HarmfulXn,FlammableF
Risk Codes: 44-36/37/38-20/22-11
Safety: 36/37/39-26-16
PSA: 58.36000
LogP: 1.23310
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Specification

The Glycine, N,N-dimethyl-,hydrazide, dihydrochloride (8Cl,9Cl), with the CAS registry number 5787-71-3, is also known as Hydrazinecarbonylmethyl-dimethyl-azanium. This chemical's molecular formula is C4H13Cl2N3O and molecular weight is 190.07. What's more, its systematic name is 2-(dimethylamino)acetohydrazide dihydrochloride (non-preferred name).

Physical properties of Glycine, N,N-dimethyl-,hydrazide, dihydrochloride (8Cl,9Cl) are: (1)ACD/LogP: -1.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.44; (4)ACD/LogD (pH 7.4): -1.91; (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): 1.67; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.79 Å2 ; (13)Flash Point: 108.7 °C; (14)Enthalpy of Vaporization: 49.36 kJ/mol; (15)Boiling Point: 256.1 °C at 760 mmHg; (16)Vapour Pressure: 0.0157 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health and may catch fire in contact with air, only need brief contact with an ignition source. It has a very low flash point or evolve highly flammable gases in contact with water. You would risk of explosion if heated under confinement. The product is harmful by inhalation and if swallowed. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection. What's more, it is highly flammable, so you should keep it away from sources of ignition - No smoking.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.Cl.O=C(NN)CN(C)C
(2)Std. InChI: InChI=1S/C4H11N3O.2ClH/c1-7(2)3-4(8)6-5;;/h3,5H2,1-2H3,(H,6,8);2*1H
(3)Std. InChIKey: FTBXJUMTWCWCEQ-UHFFFAOYSA-N