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Home >> Chemical Listing >> Page 1571 >> 3,3-Dimethyl-1-[4-(Methylsulfanyl)Phenyl]-1-Butanone

3,3-Dimethyl-1-[4-(Methylsulfanyl)Phenyl]-1-Butanone
[CAS# 440121-15-3]

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Identification
Name 3,3-Dimethyl-1-[4-(Methylsulfanyl)Phenyl]-1-Butanone
Synonyms 3,3-dimethyl-4'-thiomethylbutyrophenone
Molecular Structure CAS#: 440121-15-3, 3,3-Dimethyl-1-[4-(Methylsulfanyl)Phenyl]-1-Butanone
Molecular Formula C13H18OS
Molecular Weight 222.35
CAS Registry Number 440121-15-3
SMILES CSc1ccc(cc1)C(=O)CC(C)(C)C
InChI 1S/C13H18OS/c1-13(2,3)9-12(14)10-5-7-11(15-4)8-6-10/h5-8H,9H2,1-4H3
InChIKey RZICHTKGCMCCRV-UHFFFAOYSA-N
Properties
Density 1.028g/cm3 (Cal.)
Boiling point 330.496°C at 760 mmHg (Cal.)
Flash point 160.714°C (Cal.)
Refractive index 1.534 (Cal.)
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