725252-86-8
1-(3,5-DIMETHYLPHENYLAMINO)CYCLOHEXANECARBOXYLIC ACID
Name1-(3,5-DIMETHYLPHENYLAMINO)CYCLOHEXANECARBOXYLIC ACID
1Identification
【Name】
1-(3,5-DIMETHYLPHENYLAMINO)CYCLOHEXANECARBOXYLIC ACID
【CAS】
【MDL】
MFCD04116958
【English Synonyms】
【Formula】
C15 H21 N O2
【MolWeight】
247.336
【Inchi】
InChI=1S/C15H21NO2/c1-11-8-12(2)10-13(9-11)16-15(14(17)18)6-4-3-5-7-15/h8-10,16H,3-7H2,1-2H3,(H,17,18)
【InChIKey】
InChIKey=ZZCKRRVKAZWIGW-UHFFFAOYSA-N
【SMILES】
Cc1cc(cc(c1)NC2(CCCCC2)C(=O)O)C
【MOL File】
1-(3,5-DIMETHYLPHENY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(3,5-DIMETHYLPHENYLAMINO)CYCLOHEXANECARBOXYLIC ACID.cml