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150-46-9 molecular structure
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150-46-9 molecular structure
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triethyl borate

ChemBase ID: 111457
Molecular Formular: C6H15BO3
Molecular Mass: 145.9925
Monoisotopic Mass: 146.11142474
SMILES and InChIs

SMILES:
 CCOB(OCC)OCC
Canonical SMILES:
 CCOB(OCC)OCC
InChI:
 InChI=1S/C6H15BO3/c1-4-8-7(9-5-2)10-6-3/h4-6H2,1-3H3
InChIKey:
 AJSTXXYNEIHPMD-UHFFFAOYSA-N

Cite this record

CBID:111457 http://www.chembase.cn/molecule-111457.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
triethyl borate
IUPAC Traditional name
triethyl borate
Synonyms
TRIETHYL BORATE
Boric acid triethyl ester
Boron ethoxide
Triethoxyborane
Triethyl borate
Boron triethoxide
Boric acid, triethyl ester
三乙氧基硼烷
三乙氧硼
硼酸三乙酯
硼酸三乙酯
CAS Number
150-46-9
EC Number
205-760-9
MDL Number
MFCD00009073
Beilstein Number
1699052
PubChem SID
24900331
162103140
PubChem CID
9009
CHEBI ID
38916
Chemspider ID
8659
Wikipedia Title
Triethyl_borate

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
Sigma Aldrich 90370 external link Add to cart T59307 external link Add to cart
MP Biomedicals 05219274 external link Add to cart
Alfa Aesar A18728 external link Add to cart
Wikipedia Triethyl_borate external link
PubChem 9009 external link
Data Source Data ID Price
Sigma Aldrich
90370 external link Add to cart Please log in.
T59307 external link Add to cart Please log in.
MP Biomedicals
05219274 external link Add to cart Please log in.
Alfa Aesar
A18728 external link Add to cart Please log in.
Data Source Data ID
Wikipedia Triethyl_borate external link
PubChem 9009 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors 3  H Donor 0 
LogD (pH = 5.5) 2.7026  LogD (pH = 7.4) 2.7026 
Log P 2.7026  Molar Refractivity 35.3865 cm3
Polarizability 15.84823 Å3 Polar Surface Area 27.69 Å2
Rotatable Bonds 6  Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
clear liquid expand Show data source
liquid expand Show data source
Melting Point
-85°C expand Show data source
-85°C expand Show data source
Boiling Point
117-118 °C(lit.) expand Show data source
117-118°C expand Show data source
118°C expand Show data source
Flash Point
11 °C expand Show data source
11°C(51°F) expand Show data source
51.8 °F expand Show data source
52 °F expand Show data source
Density
0.858 expand Show data source
0.858 g/cm3 expand Show data source
0.858 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.3740 expand Show data source
n20/D 1.374(lit.) expand Show data source
n20/D 1.376 expand Show data source
Vapor Density
5.04 (vs air) expand Show data source
Storage Warning
Moisture Sensitive expand Show data source
RTECS
ED5075000 expand Show data source
European Hazard Symbols
Flammable Flammable (F) expand Show data source
Irritant Irritant (Xi) expand Show data source
UN Number
1176 expand Show data source
UN1176 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
2 expand Show data source
Hazard Class
3 expand Show data source
Packing Group
2 expand Show data source
II expand Show data source
Risk Statements
11 expand Show data source
11-36/37/38 expand Show data source
Safety Statements
26-37-60 expand Show data source
7-16-23 expand Show data source
TSCA Listed
是 expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H225 expand Show data source
GHS Precautionary statements
P210 expand Show data source
P210-P241-P280-P303+P361+P353-P403+P235-P501A expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 1176 3/PG 2 expand Show data source
Purity
≥98.0% (GC) expand Show data source
97% expand Show data source
99% expand Show data source
Grade
technical expand Show data source
Certificate of Analysis
Download expand Show data source
Linear Formula
(C2H5O)3B expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Wikipedia Wikipedia Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05219274 external link
MP Biomedicals Rare Chemical collection
Wikipedia.org - Triethyl_borate external link
Sigma Aldrich - T59307 external link
Packaging
100, 500 mL in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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