153810-37-8
1,3-BENZOXAZOL-5-YLACETIC ACID
Name
1,3-BENZOXAZOL-5-YLACETIC ACID
Formula
C9 H7 N O3
MolWeight
177.158
1Identification
【Name】
1,3-BENZOXAZOL-5-YLACETIC ACID
【CAS】
【MDL】
MFCD04125031
【English Synonyms】
【Formula】
C9 H7 N O3
【MolWeight】
177.158
【Inchi】
InChI=1S/C9H7NO3/c11-9(12)4-6-1-2-8-7(3-6)10-5-13-8/h1-3,5H,4H2,(H,11,12)
【InChIKey】
InChIKey=MQSRDBFTKHVMKV-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc1CC(=O)O)nco2
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,3-BENZOXAZOL-5-YLACETIC ACID.cml
Quick Release
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