1001907-54-5
2-(1-(ALLYLTHIOMETHYL)CYCLOPROPYL)ACETIC ACID
Name2-(1-(ALLYLTHIOMETHYL)CYCLOPROPYL)ACETIC ACID
1Identification
【Name】
2-(1-(ALLYLTHIOMETHYL)CYCLOPROPYL)ACETIC ACID
【CAS】
【MDL】
MFCD17012827
【English Synonyms】
【Formula】
C9 H14 O2 S
【MolWeight】
186.274
【Inchi】
InChI=1S/C9H14O2S/c1-2-5-12-7-9(3-4-9)6-8(10)11/h2H,1,3-7H2,(H,10,11)
【InChIKey】
InChIKey=DZKGIJIEFLDZOV-UHFFFAOYSA-N
【SMILES】
C=CCSCC1(CC1)CC(=O)O
【MOL File】
2-(1-(ALLYLTHIOMETHY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(1-(ALLYLTHIOMETHYL)CYCLOPROPYL)ACETIC ACID.cml