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5-Isothiocyanato-1,3-Benzenedicarboxylic Acid Dimethyl Ester
[CAS# 72076-50-7]

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Identification
Name 5-Isothiocyanato-1,3-Benzenedicarboxylic Acid Dimethyl Ester
Synonyms 5-Isothiocyanatobenzene-1,3-Dicarboxylic Acid Dimethyl Ester; 5-Isothiocyanato-Isophthalic Acid Dimethyl Ester; Zinc04343372
Molecular Structure CAS#: 72076-50-7, 5-Isothiocyanato-1,3-Benzenedicarboxylic Acid Dimethyl Ester
Molecular Formula C11H9NO4S
Molecular Weight 251.26
CAS Registry Number 72076-50-7
SMILES S=C=NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC
InChI 1S/C11H9NO4S/c1-15-10(13)7-3-8(11(14)16-2)5-9(4-7)12-6-17/h3-5H,1-2H3
InChIKey SEFVBTNZOHDLLS-UHFFFAOYSA-N
Properties
Density 1.254g/cm3 (Cal.)
Boiling point 399.903°C at 760 mmHg (Cal.)
Flash point 195.655°C (Cal.)
Safety Data
SDS Available
Market Analysis Reports
List of Reports Available for 5-Isothiocyanato-1,3-Benzenedicarboxylic Acid Dimethyl Ester
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