CAS Registry Number®
618-88-2
CAS Name
5-Nitroisophthalic acid
Molecular Formula
C8H5NO6
Molecular Mass
211.13
Compound Properties
-
Melting Point (1)
255-256 °C
Source(s)
- (1) Holleman, Arnold F.; Pr. K. Akad. Wetensch., Amsterdam, (1907), 9, 286-92, CAplus
Other Names and Identifiers
InChI
InChI=1S/C8H5NO6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)(H,12,13)
InChIKey
InChIKey=NBDAHKQJXVLAID-UHFFFAOYSA-N
SMILES
C(O)(=O)C1=CC(C(O)=O)=CC(N(=O)=O)=C1
Canonical SMILES
O=C(O)C=1C=C(C=C(C1)N(=O)=O)C(=O)O
Other Names for this Substance
- 1,3-Benzenedicarboxylic acid, 5-nitro-
- Isophthalic acid, 5-nitro-
- 5-Nitro-1,3-benzenedicarboxylic acid
- 5-Nitroisophthalic acid
- 1-Nitrobenzene-3,5-dicarboxylic acid
- 5-Nitro-m-phthalic acid
- NSC 66545
