Results for:
PubChem ID: 10911

2,2,4,4,6,6,8,8,10,10,12,12-dodecamethyl-1,3,5,7,9,11-hexaoxa-2,4,6,8,10,12-hexasilacyclododecane

Compound Details

Synonymous names
DODECAMETHYLCYCLOHEXASILOXANE
540-97-6
Cyclohexasiloxane, dodecamethyl-
Cyclomethicone 6
2,2,4,4,6,6,8,8,10,10,12,12-dodecamethyl-1,3,5,7,9,11-hexaoxa-2,4,6,8,10,12-hexasilacyclododecane
XHK3U310BA
2,2,4,4,6,6,8,8,10,10,12,12-Dodecamethylcyclohexasiloxane
EINECS 208-762-8
UNII-XHK3U310BA
HSDB 7723
EC 208-762-8
dodecamethyl cyclohexasiloxane
SCHEMBL93785
XIAMETER PMX-0246
CYCLOHEXASILOXANE [INCI]
DTXSID6027183
IUMSDRXLFWAGNT-UHFFFAOYSA-
CHEBI:191103
CYCLOMETHICONE 6 [USP-RS]
MFCD00144215
CYCLOHEXASILOXANE, DODECAMETHYL
AKOS015839990
FS-5671
DODECAMETHYLCYCLOHEXASILOXANE [MI]
DODECAMETHYLCYCLOHEXASILOXANE [HSDB]
DB-008587
D2040
DODECAMETHYLCYCLOHEXASILOXANE [WHO-DD]
NS00042693
S08515
T71035
Dodecamethylcyclohexasiloxane, analytical standard
A914553
Q27293843
2,2,4,4,6,6,8,8,10,10,12,12-Dodecamethylcyclohexasiloxane #
Cyclohexasiloxane, 2,2,4,4,6,6,8,8,10,10,12,12-dodecamethyl-
2,2,4,4,6,6,8,8,10,10,12,12-Dodecamethylcyclohexasiloxane, 95%
2,2,4,4,6,6,8,8,10,10,12,12-Dodecamethylcyclohexasiloxane, AldrichCPR
Cyclomethicone 6, United States Pharmacopeia (USP) Reference Standard
2,2,4,4,6,6,8,8,10,10,12,12-dodecamethyl-1,3,5,7,9,11-hexaoxa-2,4,6,8,10,12-hexa
D-6
InChI=1/C12H36O6Si6/c1-19(2)13-20(3,4)15-22(7,8)17-24(11,12)18-23(9,10)16-21(5,6)14-19/h1-12H3
Microorganism:

Yes

IUPAC name2,2,4,4,6,6,8,8,10,10,12,12-dodecamethyl-1,3,5,7,9,11-hexaoxa-2,4,6,8,10,12-hexasilacyclododecane
SMILESC[Si]1(O[Si](O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)(C)C)C
InchiInChI=1S/C12H36O6Si6/c1-19(2)13-20(3,4)15-22(7,8)17-24(11,12)18-23(9,10)16-21(5,6)14-19/h1-12H3
FormulaC12H36O6Si6
PubChem ID10911
Molweight444.92
LogP0
Atoms24
Bonds0
H-bond Acceptor6
H-bond Donor0
Chemical Classificationorganosilicon compounds
CHEBI-ID191103
Supernatural-IDSN0155663

mVOC Specific Details

Boiling Point
DegreeReference
245 °C peer reviewed
Volatilization
The Henry's Law constant for dodecamethylcyclohexasiloxane is 25.0 atm-cu m/mole(1). This Henry's Law constant indicates that dodecamethylcyclohexasiloxane is expected to volatilize rapidly from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 6.2 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 8.4 days(SRC). However, volatilization from water surfaces is expected to be attenuated by adsorption to suspended solids and sediment in the water column. The estimated volatilization half-life from a model pond is >1 year if adsorption is considered(3). The Henry's Law constant for dodecamethylcyclohexasiloxane indicates that volatilization from moist soil surfaces is expected(SRC). Dodecamethylcyclohexasiloxane is a volatile methylsiloxane that favors partitioning into the atmosphere(4); therefore, dodecamethylcyclohexasiloxane is expected to volatilize from dry soil surfaces(SRC) even with a vapor pressure of 0.0169 mm Hg(5). Evaporation of dodecamethylcyclohexasiloxane was measured in soil studies and found to occur with rates varying with moisture content, soil type and relative humidity(6). Volatilization from soil may be the major loss process under certain moist conditions(7).
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc of dodecamethylcyclohexasiloxane can be estimated to be 870,000(SRC). According to a classification scheme(2), this estimated Koc value suggests that dodecamethylcyclohexasiloxane is expected to be immobile in soil.

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaStenotrophomonas Maltophiliaantifungal activity against Colletotrichum nymphaeaeisolated from the healthy strawberry leaf in Kamyaran, Kurdistan provinceAlijani et al. 2020
EukaryotaZygosaccharomyces RouxiiNANAPei et al. 2022
EukaryotaPhytophthora CinnamomiN/APhytophthora cinnamomiQiu R et al. 2014
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaStenotrophomonas MaltophiliaNA mediaGC-MSno
EukaryotaZygosaccharomyces RouxiiYPD mediumGC-MSno
EukaryotaPhytophthora CinnamomiPotato Dextrose AgarSPME/GC-MS/MSno