5451-55-8

Name 4-TERT-BUTYLCYCLOHEXANECARBOXYLIC ACID
CAS 5451-55-8
Molecular Formula C11H20O2
MDL Number MFCD00042622
Molecular Weight 184.28
MOL File 5451-55-8.mol
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Chemical Properties

Appearance WHITE FINE CRYSTALS OR CRYSTALLINE POWDER
Melting point  148 °C (lit.)
Boiling point  282.9±8.0 °C(Predicted)
density  0.996±0.06 g/cm3(Predicted)
storage temp.  Store below +30°C.
solubility  soluble in Methanol
form  powder to crystal
pka 4.92±0.10(Predicted)
color  White to Almost white
BRN  2043187
InChI InChI=1S/C11H20O2/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h8-9H,4-7H2,1-3H3,(H,12,13)
InChIKey QVQKEGYITJBHRQ-UHFFFAOYSA-N
SMILES C1(C(O)=O)CCC(C(C)(C)C)CC1
CAS DataBase Reference 5451-55-8(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P280a-P304+P340-P305+P351+P338-P405-P501a-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
WGK Germany  3
REACH Registrations Inactive
HS Code  2916200090
Storage Class 11 - Combustible Solids

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