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(9Z,12Z)-1,1,3,3-tetrabutyl-1,3-bis(octadeca-9,12-dienoyloxy)distannoxane

HCID 44150577
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
94349-26-5
Standard SMILES
CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O][Sn]([CH2]CCC)([CH2]CCC)[O][Sn]([CH2]CCC)([CH2]CCC)[O]C(=O)CCCCCCC/C=C\C/C=C\CCCCC
InChIKey
LJBNWUJGXCTIAQ-HGMCVETQSA-L
Molecular formula
C52H98O5Sn2
Average molar mass
1,040.7 g/mol
Monoisotopic mass
1,042.54583

Names & identifiers

Preferred name
(9Z,12Z)-1,1,3,3-tetrabutyl-1,3-bis(octadeca-9,12-dienoyloxy)distannoxane
IUPAC
[dibutyl-[dibutyl-[(9Z,12Z)-octadeca-9,12-dienoyl]oxystannyl]oxystannyl] (9Z,12Z)-octadeca-9,12-dienoate
English name
(9Z,12Z)-1,1,3,3-tetrabutyl-1,3-bis(octadeca-9,12-dienoyloxy)distannoxane
Molecular formula
C52H98O5Sn2
Molecular weight
1040.75

Names & synonyms

EINECS 305-143-5(9Z,12Z)-1,1,3,3-Tetrabutyl-1,3-bis(octadeca-9,12-dienoyloxy)distannoxaneDTXSID701130055Distannoxane, 1,1,3,3-tetrabutyl-1,3-bis[(1-oxo-9,12-octadecadienyl)oxy]-, (all-Z)-Distannoxane, 1,1,3,3-tetrabutyl-1,3-bis((1-oxo-9,12-octadecadienyl)oxy)-, (all-Z)-RefChem:405612DTXCID301561543305-143-594349-26-51,1,3,3-Tetrabutyl-1,3-bis{[(9Z,12Z)-octadeca-9,12-dienoyl]oxy}distannoxaneOxybis[dibutyl[[(9Z,12Z)-1-oxooctadeca-9,12-dienyl]oxy]stannane]Distannoxane, 1,1,3,3-tetrabutyl-1,3-bis[(1-oxo-9,12-octadecadienyl)oxy]-, (all-Z)- (9CI)
Show more names
[dibutyl-[dibutyl-[(9Z,12Z)-octadeca-9,12-dienoyl]oxystannyl]oxystannyl] (9Z,12Z)-octadeca-9,12-dienoate

Database identifiers

CAS
94349-26-5
PubChem CID
44150577
DTXSID
DTXSID701130055
EC Number
305-143-5

Properties

Computed structural properties

Topological polar surface area
61.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
46
Heavy atoms
59
Formal charge
0
Complexity
969

Physicochemical properties

Boiling point
801.8 · 801.8±75.0 °C(Predicted)
Symbol(GHS)
8 · GHS08
Signal word
Danger
Hazard statements
341 · H341-H372-H360-H400-H410
Precautionary statements
273 · P273-P391-P501-P273-P391-P501-P201-P202-P281-P308+P313-P405-P501-P260-P264-P270-P314-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H341 (100%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]

P203, P260, P264, P270, P273, P280, P318, P319, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 55 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationChemical: Distannoxane, 1,1,3,3-tetrabutyl-1,3-bis[(1-oxo-9,12-octadecadienyl)oxy]-, (all-Z)-
Hazard Classes and CategoriesMuta. 2 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS08
Hazard statements
H341-H372-H360-H400-H410
Precautionary statements
P273-P391-P501-P273-P391-P501-P201-P202-P281-P308+P313-P405-P501-P260-P264-P270-P314-P501

Related reactions

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Compound notes

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