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1722-26-5 molecular structure
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triethylamine borane

ChemBase ID: 90676
Molecular Formular: C6H18BN
Molecular Mass: 115.02482
Monoisotopic Mass: 115.15322998
SMILES and InChIs

SMILES:
N(CC)(CC)CC.B
Canonical SMILES:
CCN(CC)CC.B
InChI:
InChI=1S/C6H15N.BH3/c1-4-7(5-2)6-3;/h4-6H2,1-3H3;1H3
InChIKey:
KDKNBGWKECQREO-UHFFFAOYSA-N

Cite this record

CBID:90676 http://www.chembase.cn/molecule-90676.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
triethylamine borane
IUPAC Traditional name
TEN borane
triethylamine borane
Synonyms
Borane N,N-diethylethylamine complex
Borane triethylamine complex
Borane-triethylamine complex
三乙基氨硼烷络合物
CAS Number
1722-26-5
EC Number
217-022-3
MDL Number
MFCD00012423
PubChem SID
162077437
PubChem CID
6330188

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 6330188 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -2.2147028  LogD (pH = 7.4) -1.4690653 
Log P 1.2605933  Molar Refractivity 34.2339 cm3
Polarizability 13.342089 Å3 Polar Surface Area 3.24 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
Liquid expand Show data source
Melting Point
-4°C expand Show data source
Boiling Point
97°C/12mm expand Show data source
Flash Point
-6°C(21°F) expand Show data source
Density
0.777 expand Show data source
Storage Warning
Highly Flammable/Corrosive/Harmful/Moisture Sensitive/Store under Argon expand Show data source
Moisture Sensitive expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Flammable Flammable (F) expand Show data source
X expand Show data source
UN Number
UN2924 expand Show data source
Hazard Class
3 expand Show data source
Packing Group
II expand Show data source
Risk Statements
11-20/21/22-34 expand Show data source
Safety Statements
16-26-36/37/39-45 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS05 expand Show data source
GHS06 expand Show data source
GHS Hazard statements
H225-H301-H311-H332-H314-H318 expand Show data source
GHS Precautionary statements
P210-P301+P310-P303+P361+P353-P305+P351+P338-P361-P405-P501A expand Show data source
Purity
96% expand Show data source
Packaging
packaged under Argon in resealable ChemSeal? bottles expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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