906353-00-2
4-[(6-METHYLPYRAZIN-2-YL)OXY]BENZOIC ACID
Name4-[(6-METHYLPYRAZIN-2-YL)OXY]BENZOIC ACID
1Identification
【Name】
4-[(6-METHYLPYRAZIN-2-YL)OXY]BENZOIC ACID
【CAS】
【MDL】
MFCD09817529
【EnglishSynonyms】
【pro_formula】
C12 H10 N2 O3
【pro_molWeight】
230.222
【Inchi】
InChI=1S/C12H10N2O3/c1-8-6-13-7-11(14-8)17-10-4-2-9(3-5-10)12(15)16/h2-7H,1H3,(H,15,16)
【InChIKey】
InChIKey=PPGBPVGCYRDKMI-UHFFFAOYSA-N
【SMILES】
Cc1cncc(n1)Oc2ccc(cc2)C(=O)O
【MOL File】
4-[(6-METHYLPYRAZIN-….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:5
XLogP3:2.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
4-[(6-METHYLPYRAZIN-2-YL)OXY]BENZOIC ACID.cml