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12007-99-7

12007-99-7 Structure

12007-99-7 Structure
IdentificationMore
[Name]

CALCIUM BORIDE
[CAS]

12007-99-7
[Synonyms]

CALCIUM BORIDE
CALCIUM HEXABORIDE
(oc-6-11)-calciumboride(cab6
Calciumboride(CaB6),(OC-6-11)-
CALCIUM HEXABORIDE,-200 MESH
(oc-6-11)-calcium boride
Calcium boride(CaB6)
Calcium boride, 95+%
Calcium boride, 99.5%
Calcium boride, 99+% (metals basis)
Calcium boride, 99.5% (metals basis)
[EINECS(EC#)]

234-525-3
[Molecular Formula]

B6Ca
[MDL Number]

MFCD00148904
[Molecular Weight]

104.94
[MOL File]

12007-99-7.mol
Chemical PropertiesBack Directory
[Melting point ]

2235°C
[density ]

2.3 g/mL at 25 °C(lit.)
[form ]

Powder
[color ]

refractory solid
[Specific Gravity]

2.3
[Resistivity]

222 (ρ/μΩ.cm)
[Water Solubility ]

Insoluble in water. Dissolves slowly in acids
[Thermal Conductivity]

39.162 W/(m·K)
[Crystal Structure]

Cubic a = 413.77 pm D2 , cP7, Pm3m 1 CaB type (Z = 1)
[InChI]

InChI=1S/B6.Ca/c1-2-5(1)3-4(5)6(1,2)3;/q-2;+2
[InChIKey]

AWVIDOFQNLOVRC-UHFFFAOYSA-N
[SMILES]

[B-]123B4[B-]5(B14)B2B35.[Ca+2]
[Modulus of Elasticity]

451 GPa
[CAS DataBase Reference]

12007-99-7(CAS DataBase Reference)
[EPA Substance Registry System]

Calcium boride (CaB6), (OC-6-11)- (12007-99-7)
Hazard InformationBack Directory
[Chemical Properties]

black cub; -200 mesh 99.5% pure; refractory material [KIR78] [CER91] [CRC10]
[Description]

Typical samples of CaB6 are nonstoichiometric, i.e. the ratio of boron to calcium is not exactly 6:1, for example the ultra-fine powders of CaB6 produced by some researchers had B:Ca ratio of 5.91:1. It is an important material due to its high electrical conductivity, hardness, chemical stability, and melting point.
[Physical properties]

Calcium boride is a black, lustrous, chemically inert powder with a low density. Calcium hexaboride is insoluble in H2O, MeOH (methanol), and EtOH (ethanol) and dissolves slowly in acids. It has the cubic structure typical for metal hexaborides, with octahedral units of six boron atoms combined with calcium atoms.
[Uses]

Carbon hexaboride is used in the manufacturing of boron-alloyed steel. Also, calcium hexaboride is used as a deoxidation agent in production of oxygen-free copper, which results in higher conductivity than conventionally phosphorus-deoxidized copper owing to the low solubility of boron in copper. Also, it can serve as a high temperature material, surface protection, abrasives, tools, and wear-resistant material.
[Preparation]

Calcium boride can be formed directly from the elements. Ca melts at 842°C and boron melts at 2076°C. Therefore, if a vapor of Ca metal at >850°C (red-heat) is passed over crystals of boron, a gas–solid reaction forms the desired boride. However, to obtain stoichiometric compositions, it is better to heat the well-mixed powders of Ca and B to obtain specific compounds:
Ca+ 6B→CaB6
[Flammability and Explosibility]

Notclassified
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[TSCA ]

Yes
[REACH Registrations]

Active
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

Calcium boride, 99+% (metals basis)(12007-99-7)
[Sigma Aldrich]

12007-99-7(sigmaaldrich)
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