115553-92-9
2-THIAZOLECARBOXYLIC ACID, 4-BUTYL-
Name
2-THIAZOLECARBOXYLIC ACID, 4-BUTYL-
Formula
C8 H11 N O2 S
MolWeight
185.246
1Identification
【Name】
2-THIAZOLECARBOXYLIC ACID, 4-BUTYL-
【CAS】
【MDL】
MFCD11113315
【English Synonyms】
【Formula】
C8 H11 N O2 S
【MolWeight】
185.246
【Inchi】
InChI=1S/C8H11NO2S/c1-2-3-4-6-5-12-7(9-6)8(10)11/h5H,2-4H2,1H3,(H,10,11)
【InChIKey】
InChIKey=ZFIWKJHKLOTFNV-UHFFFAOYSA-N
【SMILES】
CCCCc1csc(n1)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-THIAZOLECARBOXYLIC ACID, 4-BUTYL-.cml
Quick Release
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