54023-03-9
5-(4-CHLORO-3-NITRO-PHENYL)-FURAN-2-CARBOXYLIC ACID
Name
5-(4-CHLORO-3-NITRO-PHENYL)-FURAN-2-CARBOXYLIC ACID
Formula
C11 H6 Cl N O5
MolWeight
267.623
1Identification
【Name】
5-(4-CHLORO-3-NITRO-PHENYL)-FURAN-2-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD02258013
【English Synonyms】
【Formula】
C11 H6 Cl N O5
【MolWeight】
267.623
【Inchi】
InChI=1S/C11H6ClNO5/c12-7-2-1-6(5-8(7)13(16)17)9-3-4-10(18-9)11(14)15/h1-5H,(H,14,15)
【InChIKey】
InChIKey=UWEJMVXMOALHJB-UHFFFAOYSA-N
【SMILES】
c1cc(c(cc1c2ccc(o2)C(=O)O)[N+](=O)[O-])Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-(4-CHLORO-3-NITRO-PHENYL)-FURAN-2-CARBOXYLIC ACID.cml
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