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Home >> Chemical Listing >> Page 1687 >> 4-(3,4-Dimethylphenyl)-4-Oxobutanoic Acid

4-(3,4-Dimethylphenyl)-4-Oxobutanoic Acid
[CAS# 51036-98-7]

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Identification
Name 4-(3,4-Dimethylphenyl)-4-Oxobutanoic Acid
Synonyms 4-(3,4-Dimethylphenyl)-4-Oxo-Butanoate; 4-(3,4-Dimethylphenyl)-4-Keto-Butyrate; Zinc01766311
Molecular Structure CAS#: 51036-98-7, 4-(3,4-Dimethylphenyl)-4-Oxobutanoic Acid
Molecular Formula C12H13O3
Molecular Weight 205.23
CAS Registry Number 51036-98-7
SMILES C1=C(C(=O)CCC([O-])=O)C=CC(=C1C)C
InChI 1S/C12H14O3/c1-8-3-4-10(7-9(8)2)11(13)5-6-12(14)15/h3-4,7H,5-6H2,1-2H3,(H,14,15)/p-1
InChIKey UXIHUHNPOHTZAQ-UHFFFAOYSA-M
Properties
Boiling point 402.061°C at 760 mmHg (Cal.)
Flash point 211.119°C (Cal.)
Safety Data
SDS Available
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