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6731-36-8

Name 1,1-Di-(tert-butylperoxy)-3,3,5-trimethylcyclohexane
CAS 6731-36-8
EINECS(EC#) 229-782-3
Molecular Formula C17H34O4
MDL Number MFCD00084801
Molecular Weight 302.45
MOL File 6731-36-8.mol

Chemical Properties

Appearance clear solution
Melting point  -20 °C
Boiling point  403.47°C (rough estimate)
density  0.895
vapor pressure  0.009Pa at 20℃
refractive index  n20/D 1.441(lit.)
Fp  62 °C
storage temp.  Refrigerator (+4°C)
solubility  Acetonitrile (Slightly), Chloroform (Sparingly)
form  Solution
color  Clear
Water Solubility  immiscible
InChI InChI=1S/C17H34O4/c1-13-10-16(8,9)12-17(11-13,20-18-14(2,3)4)21-19-15(5,6)7/h13H,10-12H2,1-9H3
InChIKey NALFRYPTRXKZPN-UHFFFAOYSA-N
SMILES O(C1(CC(C)CC(C)(C)C1)OOC(C)(C)C)OC(C)(C)C
LogP 7 at 25℃
CAS DataBase Reference 6731-36-8(CAS DataBase Reference)
EPA Substance Registry System 6731-36-8(EPA Substance)

Safety Data

Hazard Codes  O,Xi,N,T
Risk Statements 
R8:Contact with combustible material may cause fire.
R7:May cause fire.
R41:Risk of serious damage to eyes.
R37/38:Irritating to respiratory system and skin .
R36/37/38:Irritating to eyes, respiratory system and skin .
R62:Possible risk of impaired fertility.
R50:Very Toxic to aquatic organisms.
R61:May cause harm to the unborn child.
Safety Statements 
S7:Keep container tightly closed .
S17:Keep away from combustible material .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S3/7:Keep container tightly closed in a cool place .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S14:Keep away from ... (incompatible materials to be indicated by the manufacturer) .
S47:Keep at temperature not exceeding ... E C (to be specified by the manufacturer) .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S53:Avoid exposure-obtain special instruction before use .
RIDADR  UN 3110 5.2
WGK Germany  3
RTECS  SD8600000
HazardClass  5.2
PackingGroup  II
HS Code  29096000

Hazard Information

Material Safety Data Sheet(MSDS)

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