939761-22-5
4-[[(2-CHLOROPHENYL)METHYL]AMINO]TETRAHYDRO-2H-PYRAN-4-CARBOXYLIC ACID
Name
4-[[(2-CHLOROPHENYL)METHYL]AMINO]TETRAHYDRO-2H-PYRAN-4-CARBOXYLIC ACID
Formula
C13 H16 Cl N O3
MolWeight
269.726
1Identification
【Name】
4-[[(2-CHLOROPHENYL)METHYL]AMINO]TETRAHYDRO-2H-PYRAN-4-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD09025968
【English Synonyms】
【Formula】
C13 H16 Cl N O3
【MolWeight】
269.726
【Inchi】
InChI=1S/C13H16ClNO3/c14-11-4-2-1-3-10(11)9-15-13(12(16)17)5-7-18-8-6-13/h1-4,15H,5-9H2,(H,16,17)
【InChIKey】
InChIKey=IJFCFZUWOFWKNS-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)CNC2(CCOCC2)C(=O)O)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[[(2-CHLOROPHENYL)METHYL]AMINO]TETRAHYDRO-2H-PYRAN-4-CARBOXYLIC ACID.cml
Quick Release
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3-(1-Methylpiperidin-4-yl)-1H-indolehydrochloride
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