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Ethyl hydrogen suberate
[CAS# 14113-01-0]

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Identification
Name Ethyl hydrogen suberate
Synonyms 8-ethoxy-8-oxooctanoic acid
Molecular Structure CAS # 14113-01-0 (68171-34-6), Ethyl hydrogen suberate, 8-ethoxy-8-oxooctanoic acid
Molecular Formula C10H18O4
Molecular Weight 202.25
CAS Registry Number 14113-01-0 (68171-34-6)
EC Number 237-968-0
SMILES CCOC(=O)CCCCCCC(=O)O
Properties
Solubility 670.3 mg/L (25 ºC water)
Density 1.1±0.1 g/cm3, Calc.*
Index of Refraction 1.452, Calc.*
Melting point 89.91 ºC
Boiling Point 312.40 ºC, 304.7±25.0 ºC (760 mmHg), Calc.*
Flash Point 111.7±16.7 ºC, Calc.*
* Calculated using Advanced Chemistry Development (ACD/Labs) Software.
Safety Data
Hazard Symbols symbol   GHS07 Warning    Details
Hazard Statements H315-H319    Details
Precautionary Statements P264-P264+P265-P280-P302+P352-P305+P351+P338-P321-P332+P317-P337+P317-P362+P364    Details
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