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Structure

Benzoic acid,4-[[(2-furanylmethyl)thio]methyl]-

CAS
312517-86-5
Catalog Number
ACM312517865
Category
Other Products
Molecular Weight
248.3
Molecular Formula
C13H12O3S

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Specification

Synonyms
TIMTEC-BB SBB000877;4-(FURAN-2-YLMETHYLSULFANYLMETHYL)-BENZOIC ACID
IUPAC Name
4-(furan-2-ylmethylsulfanylmethyl)benzoate
Canonical SMILES
C1=COC(=C1)CSCC2=CC=C(C=C2)C(=O)O
InChI Key
YKWFODPJEKPJPA-UHFFFAOYSA-M
Boiling Point
408.5ºC at 760mmHg
Flash Point
200.8ºC
Density
g/cm³
Exact Mass
248.05100
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
3
H-Bond Donor
0
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