53985-46-9
3-CHLORO-5-(METHYLTHIO)BENZOIC ACID
Name
3-CHLORO-5-(METHYLTHIO)BENZOIC ACID
Formula
C8 H7 Cl O2 S
MolWeight
202.66
1Identification
【Name】
3-CHLORO-5-(METHYLTHIO)BENZOIC ACID
【CAS】
【MDL】
MFCD22489505
【English Synonyms】
【Formula】
C8 H7 Cl O2 S
【MolWeight】
202.66
【Inchi】
InChI=1S/C8H7ClO2S/c1-12-7-3-5(8(10)11)2-6(9)4-7/h2-4H,1H3,(H,10,11)
【InChIKey】
InChIKey=NHMAJWOUAWHETL-UHFFFAOYSA-N
【SMILES】
CSc1cc(cc(c1)Cl)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
3-CHLORO-5-(METHYLTHIO)BENZOIC ACID.cml
Quick Release
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