890984-16-4
(3-[(CYCLOPROPYLCARBONYL)AMINO]PHENOXY)ACETIC ACID
Name(3-[(CYCLOPROPYLCARBONYL)AMINO]PHENOXY)ACETIC ACID
1Identification
【Name】
(3-[(CYCLOPROPYLCARBONYL)AMINO]PHENOXY)ACETIC ACID
【CAS】
【MDL】
MFCD07113971
【English Synonyms】
【Formula】
C12 H13 N O4
【MolWeight】
235.238
【Inchi】
InChI=1S/C12H13NO4/c14-11(15)7-17-10-3-1-2-9(6-10)13-12(16)8-4-5-8/h1-3,6,8H,4-5,7H2,(H,13,16)(H,14,15)
【InChIKey】
InChIKey=FWXXKIDBHZJNTO-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)OCC(=O)O)NC(=O)C2CC2
【MOL File】
(3-[(CYCLOPROPYLCARB….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(3-[(CYCLOPROPYLCARBONYL)AMINO]PHENOXY)ACETIC ACID.cml