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Methyl 4-tert-butyldithiobenzoate
[CAS# 58863-42-6]

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CAS#: 58863-42-6
Product: Methyl 4-tert-butyldithiobenzoate
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Identification
Name Methyl 4-tert-butyldithiobenzoate
Synonyms 4-Tert-Butylbenzenecarbodithioic Acid Methyl Ester; Benzenecarbodithioic Acid, 4-(1,1-Dimethylethyl)Methyl Ester; Methyl 4-Tert-Butyl-Dithiabenzoate
Molecular Structure CAS#: 58863-42-6, Methyl 4-tert-butyldithiobenzoate
Molecular Formula C12H16S2
Molecular Weight 224.38
CAS Registry Number 58863-42-6
SMILES C1=C(C=CC(=C1)C(C)(C)C)C(SC)=S
InChI 1S/C12H16S2/c1-12(2,3)10-7-5-9(6-8-10)11(13)14-4/h5-8H,1-4H3
InChIKey XGVNDLXEGXTPBM-UHFFFAOYSA-N
Properties
Density 1.071g/cm3 (Cal.)
Boiling point 304.283°C at 760 mmHg (Cal.)
Flash point 137.826°C (Cal.)
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