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2-chloranyl-4-fluoranyl-5-isothiocyanato-benzoic acid

Systemtic Name:	2-chloranyl-4-fluoranyl-5-isothiocyanato-benzoic acid
Openeye Name:	2-chloro-4-fluoro-5-isothiocyanato-benzoic acid
CAS Name:	2-chloro-4-fluoro-5-isothiocyanatobenzoic acid
IUPAC Name:	2-chloro-4-fluoro-5-isothiocyanatobenzoic acid
Traditional Name:	2-chloro-4-fluoro-5-isothiocyanato-benzoic acid
Formula:	C₈H₃ClFNO₂S
MolecularWeight:	231.631323

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1N=C=S)F)Cl)C(=O)O

Isomeric SMILES

C1=C(C(=CC(=C1N=C=S)F)Cl)C(=O)O

InChI

InChI=1S/C8H3ClFNO2S/c9-5-2-6(10)7(11-3-14)1-4(5)8(12)13/h1-2H,(H,12,13)

Other Product

2,5-bis(chloranyl)cyclohexa-2,5-diene-1,4-diol
2,5-bis(chloranyl)benzene-1,4-diol
2,5-bis(chloranyl)phenol
2-oxidanylidenehexanedioic acid
2-oxidanylidene-3-sulfanyl-propanoic acid
3-oxidanylbenzaldehyde
3-azanylpropanal
2-azanyl-3-oxidanyl-benzoic acid
3-(3-hydroxyphenyl)propanoic acid
3-oxidanylidenehexanedioic acid
2-chloranyl-4-fluoranyl-5-[(3-oxidanylidene-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]benzoyl chloride
2-methoxyethyl 2-[2-chloranyl-4-fluoranyl-5-[(3-oxidanylidene-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]carbonylsulfanylethanoate
methyl 2-[2-chloranyl-4-fluoranyl-5-[(3-oxidanylidene-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]carbonylsulfanylpropanoate
1-ethylsulfanylpropan-2-yl 2-chloranyl-4-fluoranyl-5-[(3-oxidanylidene-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]benzoate
1-methylsulfanylpropan-2-yl 2-chloranyl-4-fluoranyl-5-[(3-oxidanylidene-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]benzoate
1-(4-chlorophenyl)sulfanylpropan-2-yl 2-chloranyl-4-fluoranyl-5-[(3-oxidanylidene-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]benzoate
2-(4-methyl-1,3-thiazol-5-yl)ethyl 2-chloranyl-4-fluoranyl-5-[(3-oxidanylidene-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]benzoate
1-butylsulfanylpropan-2-yl 2-chloranyl-4-fluoranyl-5-[(3-oxidanylidene-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]benzoate
1-methoxypropan-2-yl 2-[2-chloranyl-4-fluoranyl-5-[(3-oxidanylidene-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]carbonylsulfanylethanoate
1-propan-2-ylsulfanylpropan-2-yl 2-chloranyl-4-fluoranyl-5-[(3-oxidanylidene-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]benzoate