5-Oxo-5-(4-thiomethylphenyl)valeric acid

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Catalog Number
ACM845790490
Product Name
5-Oxo-5-(4-thiomethylphenyl)valeric acid
Structure
Structure
CAS
845790-49-0
Category
Heterocyclic Organic Compound
Synonyms
5-OXO-5-(4-THIOMETHYLPHENYL)VALERIC ACID
IUPAC Name
5-(4-methylsulfanylphenyl)-5-oxopentanoic acid
Molecular Weight
238.3
Molecular Formula
C12H14O3S
Canonical SMILES
CSC1=CC=C(C=C1)C(=O)CCCC(=O)O
InChI Key
YXVDDYAHAFDVIY-UHFFFAOYSA-N
Boiling Point
456.6ºC at 760 mmHg
Flash Point
229.9ºC
Density
1.22g/cm³
Exact Mass
238.06600
H-Bond Acceptor
4
H-Bond Donor
1
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