Butanoic-d7 acid (9CI) supplier

Name
BUTYRIC-D7 ACID
EINECS
CAS No. 73607-83-7
Density 1.066 g/cm³
Solubility
Melting Point -6--3 °C(lit.)
Formula C₄HD₇O₂
Boiling Point 164.3 °C at 760 mmHg
Molecular Weight 95.0507
Flash Point 69.7 °C
Transport Information UN 2820 8/PG 3
Appearance
Safety 26-36-45
Risk Codes 34
Molecular Structure
Hazard Symbols C
Synonyms Butyric-d7acid;2,2,3,3,4,4,4-heptadeuteriobutanoic acid;Butanoic-d7 acid;butanoic-d₇ acid;(²H₇)Butanoic acid;
PSA 37.30000
LogP 0.87110

Butanoic-d7 acid (9CI) Specification

The Butanoic-d7 acid (9CI), with the CAS registry number 73607-83-7, has the systematic name of 2,2,3,3,4,4,4-heptadeuteriobutanoic acid. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₄HD₇O₂.

The characteristics of Butanoic-d7 acid (9CI) are as followings: (1)ACD/LogP: 0.78; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 37.3 Å²; (7)Index of Refraction: 1.411; (8)Molar Refractivity: 22.14 cm³; (9)Molar Volume: 89.1 cm³; (10)Polarizability: 8.77×10^-24cm³; (11)Surface Tension: 32.5 dyne/cm; (12)Density: 1.066 g/cm³; (13)Flash Point: 69.7 °C; (14)Enthalpy of Vaporization: 42.39 kJ/mol; (15)Boiling Point: 164.3 °C at 760 mmHg; (16)Vapour Pressure: 1.35 mmHg at 25°C.

You should be cautious while dealing with this chemical. It may cause burns. Therefore, you had better take the following instructions: Wear suitable protective clothing, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice. What's more, if in case of accident or if you feel unwell, seek medical advice immediately (show label where possible).

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [2H]C([2H])(C([2H])([2H])C(O)=O)C([2H])([2H])[2H]
(2)InChI: InChI=1/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6)/i1D3,2D2,3D2
(3)InChIKey: FERIUCNNQQJTOY-NCKGIQLSET

Product Name

BUTYRIC-D7 ACID

Butanoic-d7 acid (9CI) Specification

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