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12007-16-8 molecular structure
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(boranylidynechromiumylidyne)borane

ChemBase ID: 137940
Molecular Formular: B2CrH4
Molecular Mass: 77.64986
Monoisotopic Mass: 77.99041843
SMILES and InChIs

SMILES:
[BH2]#[Cr]#[BH2]
Canonical SMILES:
[BH2]#[Cr]#[BH2]
InChI:
InChI=1S/2B.Cr
InChIKey:
UHPOHYZTPBGPKO-UHFFFAOYSA-N

Cite this record

CBID:137940 http://www.chembase.cn/molecule-137940.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(boranylidynechromiumylidyne)borane
IUPAC Traditional name
(boranylidynechromiumylidyne)borane
Synonyms
Chromium boride
Chromium diboride
硼化铬
二硼化铬
CAS Number
12007-16-8
EC Number
234-499-3
MDL Number
MFCD00016043
PubChem SID
162232200
24860419
PubChem CID
3644323

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 3644323 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.044  LogD (pH = 7.4) 2.044 
Log P 2.044  Molar Refractivity 0.0 cm3
Polarizability 6.1246014 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
-325 Mesh Powder expand Show data source
powder expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
TSCA Listed
expand Show data source
Purity
≥99% expand Show data source
99% (metals basis) expand Show data source
Particle Size
-325 mesh expand Show data source
Linear Formula
CrB2 expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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