Responsive image

Common name


dinoterbon

IUPAC name


2-(1,1-dimethylethyl)-4,6-dinitrophenyl ethyl carbonate

SMILES


CCOC(=O)Oc1c(cc(cc1N(=O)=O)N(=O)=O)C(C)(C)C

Compound class


Fungicide

Therapeutic area


Fungicide

Common name


dinoterbon

IUPAC name


2-(1,1-dimethylethyl)-4,6-dinitrophenyl ethyl carbonate

SMILES


CCOC(=O)Oc1c(cc(cc1N(=O)=O)N(=O)=O)C(C)(C)C

INCHI


InChI=1S/C13H16N2O7/c1-5-21-12(16)22-11-9(13(2,3)4)6-8(14(17)18)7-10(11)15(19)20/h6-7H,5H2,1-4H3

FORMULA


C13H16N2O7

Responsive image

Common name


dinoterbon

IUPAC name


2-(1,1-dimethylethyl)-4,6-dinitrophenyl ethyl carbonate

Molecular weight


312.275

clogP


-0.478

clogS


-3.229

HBond Acceptor


9

HBond Donor


0

Total Polar
Surface Area


103.81

Number of Rings


1

Rotatable Bond


7

Drug ID Common name Structure CAS SMILE Frequency
FDBF00012 isobutane Responsive image C(C)(C)C 0.0611
FDBF02560 ethyl hydrogen carbonate Responsive image C(C)OC(=O)O 0.0014
2 , 1