CAS No.73962-07-9,ETHYL-D5 CARBAMATE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	73962-07-9
Name:	ETHYL-D5 CARBAMATE

Formula:	C₃H₂D₅NO₂
Molecular Weight:	94.12
Synonyms:	(²H₅ )Ethyl carbamate;Ethan-d₅ -ol, carbamate(9CI);Ethyl-d₅ Carbamate;Urethane-d₅ (ethyl-d₅ );
Density:	1.104 g/cm³
Melting Point:	48.5-50 °C
Boiling Point:	184 °C at 760 mmHg
Flash Point:	97.2 °C
Hazard Symbols:	T
Risk Codes:	45-46-20/21/22-36/37/38
Safety:	53-26-36/37/39-45
PSA:	52.32000
LogP:	0.80190

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Specification

The Ethan-d₅-ol, carbamate, with the CAS registry number 73962-07-9, is also known as Urethane-d₅ (ethyl-d₅). This chemical's molecular formula is C₃H₂D₅NO₂ and molecular weight is 94.12. What's more, its systematic name is (²H₅)ethyl carbamate.

Physical properties of Ethan-d₅-ol, carbamate are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 19.74; (5)ACD/KOC (pH 7.4): 19.74; (6)#H bond acceptors: 3; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 29.54 Å²; (10)Index of Refraction: 1.413; (11)Molar Refractivity: 21.25 cm³; (12)Molar Volume: 85.2 cm³; (13)Polarizability: 8.42×10^-24cm³; (14)Surface Tension: 33.6 dyne/cm; (15)Density: 1.104 g/cm³; (16)Flash Point: 97.2 °C; (17)Enthalpy of Vaporization: 42.03 kJ/mol; (18)Boiling Point: 184 °C at 760 mmHg; (19)Vapour Pressure: 0.748 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. It is irritating to eyes, respiratory system and skin. It may cause cancer and heritable genetic damage. 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. In case of accident or if you feel unwell, you should seek medical advice immediately (show the label where possible). It should be avoided exposure - obtain special instructions before use.

You can still convert the following datas into molecular structure:
(1)SMILES: [2H]C([2H])([2H])C([2H])([2H])OC(=O)N
(2)InChI: InChI=1S/C3H7NO2/c1-2-6-3(4)5/h2H2,1H3,(H2,4,5)/i1D3,2D2
(3)InChIKey: JOYRKODLDBILNP-ZBJDZAJPSA-N