574722-92-2
3-CYCLOHEXENE-1-CARBOXYLIC ACID,6-[[(3-METHYL-2-PYRIDINYL)AMINO]CARBONYL]-
Name3-CYCLOHEXENE-1-CARBOXYLIC ACID,6-[[(3-METHYL-2-PYRIDINYL)AMINO]CARBONYL]-
1Identification
【Name】
3-CYCLOHEXENE-1-CARBOXYLIC ACID,6-[[(3-METHYL-2-PYRIDINYL)AMINO]CARBONYL]-
【CAS】
【MDL】
MFCD01338245
【English Synonyms】
【Formula】
C14 H16 N2 O3
【MolWeight】
260.291
【Inchi】
InChI=1S/C14H16N2O3/c1-9-5-4-8-15-12(9)16-13(17)10-6-2-3-7-11(10)14(18)19/h2-5,8,10-11H,6-7H2,1H3,(H,18,19)(H,15,16,17)
【InChIKey】
InChIKey=VJHUBLBCUBGRRR-UHFFFAOYSA-N
【SMILES】
Cc1cccnc1NC(=O)C2CC=CCC2C(=O)O
【MOL File】
3-CYCLOHEXENE-1-CARB….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-CYCLOHEXENE-1-CARBOXYLIC ACID,6-[[(3-METHYL-2-PYRIDINYL)AMINO]CARBONYL]-.cml