5-cyanoisophthalic acid (CAS 23341-13-1) — formula C9H5NO4, molecular weight 191.14; category organic chemicals.
| CAS Number | 23341-13-1 |
|---|---|
| Molecular Formula | C9H5NO4 |
| Molecular Weight | 191.14 |
| LogP | 0.7 |
| Category | Organic Chemicals |
5-cyanoisophthalic acid is a carbon-based organic compound with CAS registry number 23341-13-1 and molecular formula C9H5NO4 (molecular weight 191.14), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 23341-13-1
Its molecular formula C9H5NO4 comprises 9 C, 5 H, 1 N, 4 O atoms.
Also known as: 5-cyanoisophthalic acid · 5-氰基-1,3-苯二甲酸
Category: organic chemicals
The CAS registry number of 5-cyanoisophthalic acid is 23341-13-1.
Molecular formula C9H5NO4, molecular weight 191.14.
It is also registered under: 5-cyanoisophthalic acid, 5-氰基-1,3-苯二甲酸.
Category: Organic Chemicals.
Independent reference data for 5-cyanoisophthalic acid (CAS 23341-13-1), compiled from public chemistry databases.
| CAS 号 | 23341-13-1 |
|---|---|
| PubChem CID | 90070 |
| 分子式 | C9H5NO4 |
| IUPAC 名称 | 5-cyanobenzene-1,3-dicarboxylic acid |
| UNII（FDA） | GWF6ER87GX |
| Molecular Weight | 191.14 |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 191.02185764 |
| Monoisotopic Mass | 191.02185764 |
| Topological Polar Surface Area | 98.4 |
| Heavy Atom Count | 14 |
5-Cyanoisophthalic acid; 23341-13-1; 5-Cyano-1,3-benzenedicarboxylic acid; 1,3-Benzenedicarboxylic acid, 5-cyano-; EINECS 245-594-4; DTXSID5066879; RefChem:535080; DTXCID0036847; 245-594-4; 5-cyanobenzene-1,3-dicarboxylic acid; GWF6ER87GX; SCHEMBL2511327; 5-Cyanoisophthalicacid,H2CyIPT; YKADUTAIRWMMFI-UHFFFAOYSA-N; MFCD16621431; AKOS028110932
| 已通报的危害声明 | H315 (100%), H319 (100%), H335 (100%) |
|---|
5-氰基-1,3-苯二甲酸 · CAS 23341-13-1 · C9H5NO4. UNII GWF6ER87GX.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 5-氰基-1,3-苯二甲酸