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10026-12-7 molecular structure
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pentachloroniobium

ChemBase ID: 147474
Molecular Formular: Cl5Nb
Molecular Mass: 270.17138
Monoisotopic Mass: 267.7506414
SMILES and InChIs

SMILES:
Cl[Nb](Cl)(Cl)(Cl)Cl
Canonical SMILES:
Cl[Nb](Cl)(Cl)(Cl)Cl
InChI:
InChI=1S/5ClH.Nb/h5*1H;/q;;;;;+5/p-5
InChIKey:
YHBDIEWMOMLKOO-UHFFFAOYSA-I

Cite this record

CBID:147474 http://www.chembase.cn/molecule-147474.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
pentachloroniobium
IUPAC Traditional name
niobium pentachloride
Synonyms
Niobium pentachloride
Niobium(V) chloride
五氯化铌
氯化铌(V)
CAS Number
10026-12-7
EC Number
233-059-8
MDL Number
MFCD00011127
PubChem SID
24852915
24860399
24873526
162241662
PubChem CID
24818

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 24818 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.1725  LogD (pH = 7.4) 3.1725 
Log P 3.1725  Molar Refractivity 30.6815 cm3
Polarizability 16.123596 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
crystals and lumps expand Show data source
powder expand Show data source
Melting Point
204.7 °C(lit.) expand Show data source
Boiling Point
254 °C(lit.) expand Show data source
Density
2.75 g/mL at 25 °C(lit.) expand Show data source
RTECS
QU0350000 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
UN Number
3260 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
8 expand Show data source
Packing Group
2 expand Show data source
Risk Statements
20/21/22-34 expand Show data source
Safety Statements
26-27-28-36/37/39 expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS07 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H302-H312-H314-H332 expand Show data source
GHS Precautionary statements
P280-P305 + P351 + P338-P310 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges expand Show data source
RID/ADR
UN 3260 8/PG 2 expand Show data source
Purity
≥99.9% trace metals basis expand Show data source
99% expand Show data source
99.995% trace metals basis expand Show data source
Grade
anhydrous expand Show data source
puriss. expand Show data source
Linear Formula
NbCl5 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 510696 external link
Packaging
5, 25 g in ampule
Application
Used to form mixed chloro-aryloxide compounds, such as [Nb(OC6H3-2,6-i-Pr2)2Cl3]2, which form pyridine or phosphine adducts with a distorted six-coordinate geometry.†
Sigma Aldrich - 215791 external link
Packaging
10, 50 g in glass bottle
Application
Used to form mixed chloro-aryloxide compounds, such as [Nb(OC6H3-2,6-i-Pr2)2Cl3]2, which form pyridine or phosphine adducts with a distorted six-coordinate geometry.†
Sigma Aldrich - 336602 external link
Packaging
10, 50 g in glass bottle
Application
Used to form mixed chloro-aryloxide compounds, such as [Nb(OC6H3-2,6-i-Pr2)2Cl3]2, which form pyridine or phosphine adducts with a distorted six-coordinate geometry.†
Sigma Aldrich - 10439 external link
Application
Used to form mixed chloro-aryloxide compounds, such as [Nb(OC6H3-2,6-i-Pr2)2Cl3]2, which form pyridine or phosphine adducts with a distorted six-coordinate geometry.†

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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