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14024-63-6 molecular structure
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2,4,8,10-tetramethyl-1$l^{3},5$l^{3}-dioxa-7$l^{3},11$l^{3}-dioxa-6-zincaspiro[5.5]undeca-1,4,7,10-tetraene-6,6-bis(ylium)-3,9-diide

ChemBase ID: 111569
Molecular Formular: C10H14O4Zn
Molecular Mass: 263.59576
Monoisotopic Mass: 262.01835093
SMILES and InChIs

SMILES:
CC1=[O][Zn+2]2([O]=C(C)[CH-]1)[O]=C(C)[CH-]C(=[O]2)C
Canonical SMILES:
CC1=[O][Zn+2]2([O]=C([CH-]1)C)[O]=C(C)[CH-]C(=[O]2)C
InChI:
InChI=1S/2C5H7O2.Zn/c2*1-4(6)3-5(2)7;/h2*3H,1-2H3;/q2*-1;+2
InChIKey:
NHXVNEDMKGDNPR-UHFFFAOYSA-N

Cite this record

CBID:111569 http://www.chembase.cn/molecule-111569.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2,4,8,10-tetramethyl-1$l^{3},5$l^{3}-dioxa-7$l^{3},11$l^{3}-dioxa-6-zincaspiro[5.5]undeca-1,4,7,10-tetraene-6,6-bis(ylium)-3,9-diide
IUPAC Traditional name
2,4,8,10-tetramethyl-1$l^{3},5$l^{3}-dioxa-7$l^{3},11$l^{3}-dioxa-6-zincaspiro[5.5]undeca-1,4,7,10-tetraene-6,6-bis(ylium)-3,9-diide
Synonyms
ZINC ACETYLACETONATE
CAS Number
14024-63-6
PubChem SID
162089692
PubChem CID
25022293

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
MP Biomedicals
05219908 external link Add to cart Please log in.
Data Source Data ID
PubChem 25022293 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
Molar Refractivity 96.4072 cm3 Polar Surface Area 136.56 Å2
Rotatable Bonds Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
137°C expand Show data source
RTECS
ZH0917500 expand Show data source
European Hazard Symbols
Flammable Flammable (F) expand Show data source
Nature polluting Nature polluting (N) expand Show data source
MSDS Link
Download expand Show data source
Risk Statements
R:15-17-58 expand Show data source
Safety Statements
S:7/8-61 expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05219908 external link
MP Biomedicals Rare Chemical collection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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