130178-54-0
1-[(2-NITROPHENYL)SULFONYL]PIPERIDINE-2-CARBOXYLIC ACID
Name1-[(2-NITROPHENYL)SULFONYL]PIPERIDINE-2-CARBOXYLIC ACID
1Identification
【Name】
1-[(2-NITROPHENYL)SULFONYL]PIPERIDINE-2-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD00720132
【English Synonyms】
【Formula】
C12 H14 N2 O6 S
【MolWeight】
314.317
【Inchi】
InChI=1S/C12H14N2O6S/c15-12(16)10-6-3-4-8-13(10)21(19,20)11-7-2-1-5-9(11)14(17)18/h1-2,5,7,10H,3-4,6,8H2,(H,15,16)
【InChIKey】
InChIKey=HBPKKCWUSYDGFM-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)[N+](=O)[O-])S(=O)(=O)N2CCCCC2C(=O)O
【MOL File】
1-[(2-NITROPHENYL)SU….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-[(2-NITROPHENYL)SULFONYL]PIPERIDINE-2-CARBOXYLIC ACID.cml