40133-07-1
4,5,6,7-TETRAHYDROBENZO[B]THIOPHENE-2-CARBOXYLIC ACID
Name4,5,6,7-TETRAHYDROBENZO[B]THIOPHENE-2-CARBOXYLIC ACID
1Identification
【Name】
4,5,6,7-TETRAHYDROBENZO[B]THIOPHENE-2-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD00464469
【English Synonyms】
【Formula】
C9 H10 O2 S
【MolWeight】
182.242
【Inchi】
InChI=1S/C9H10O2S/c10-9(11)8-5-6-3-1-2-4-7(6)12-8/h5H,1-4H2,(H,10,11)
【InChIKey】
InChIKey=ROLXOQXKNDKXTA-UHFFFAOYSA-N
【SMILES】
c1c2c(sc1C(=O)O)CCCC2
【MOL File】
4,5,6,7-TETRAHYDROBE….mol
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)
【WGK Germany】
3
4CML File
4,5,6,7-TETRAHYDROBENZO[B]THIOPHENE-2-CARBOXYLIC ACID.cml