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89205-04-9
5-(4-METHYLPHENYL)-1,3-OXAZOLE-4-CARBOXYLIC ACID
Name
5-(4-METHYLPHENYL)-1,3-OXAZOLE-4-CARBOXYLIC ACID
Formula
C11 H9 N O3
MolWeight
203.196
1Identification
【Name】
5-(4-METHYLPHENYL)-1,3-OXAZOLE-4-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD04112093
【English Synonyms】
【Formula】
C11 H9 N O3
【MolWeight】
203.196
【Inchi】
InChI=1S/C11H9NO3/c1-7-2-4-8(5-3-7)10-9(11(13)14)12-6-15-10/h2-6H,1H3,(H,13,14)
【InChIKey】
InChIKey=SEGAPYFKYCVPBR-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)c2c(nco2)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-(4-METHYLPHENYL)-1,3-OXAZOLE-4-CARBOXYLIC ACID.cml
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