Concept information
Preferred term
4 ایزوتیوسیاناتوبنزوات
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- -1
formula
- C8H4NO2S
inchi
- InChI=1S/C8H5NO2S/c10-8(11)6-1-3-7(4-2-6)9-5-12/h1-4H,(H,10,11)/p-1
inchikey
- RBEFRYQKJYMLCC-UHFFFAOYSA-M
is_conjugate_base_of
mass
- 178.18800
monoisotopicmass
- 177.99682
smiles
- [O-]C(=O)c1ccc(cc1)N=C=S
subset
- 3_STAR
synonym EXACT
- 4-isothiocyanatobenzoate
synonym RELATED
- p-NCS-benzoate
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:64463
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