4-oxo-5-(4,5,6,7-tetrahydro-3-methyl-7-oxobenzothiazol-2(3H)-ylidene)-2-thioxothiazolidin-3-acetic acid (CAS 30906-38-8) — formula C13H12N2O4S3, molecular weight 356.4; category organic chemicals.
| CAS Number | 30906-38-8 |
|---|---|
| Molecular Formula | C13H12N2O4S3 |
| Molecular Weight | 356.4 |
| LogP | 1.7 |
| Category | Organic Chemicals |
4-oxo-5-(4,5,6,7-tetrahydro-3-methyl-7-oxobenzothiazol-2(3H)-ylidene)-2-thioxothiazolidin-3-acetic acid is a carbon-based organic compound with CAS registry number 30906-38-8 and molecular formula C13H12N2O4S3 (molecular weight 356.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 30906-38-8
Its molecular formula C13H12N2O4S3 comprises 13 C, 12 H, 2 N, 4 O, 3 S atoms.
Also known as: 4-oxo-5-(4,5,6,7-tetrahydro-3-methyl-7-oxobenzothiazol-2(3H)-ylidene)-2-thioxothiazolidin-3-acetic acid · 4-氧代-5-(4,5,6,7-四氢-3-甲基-7-氧代苯并噻唑-2(3H)-亚基)-2-硫代噻唑烷-3-乙酸
Category: organic chemicals
The CAS registry number of 4-oxo-5-(4,5,6,7-tetrahydro-3-methyl-7-oxobenzothiazol-2(3H)-ylidene)-2-thioxothiazolidin-3-acetic acid is 30906-38-8.
Molecular formula C13H12N2O4S3, molecular weight 356.4.
It is also registered under: 4-oxo-5-(4,5,6,7-tetrahydro-3-methyl-7-oxobenzothiazol-2(3H)-ylidene)-2-thioxothiazolidin-3-acetic acid, 4-氧代-5-(4,5,6,7-四氢-3-甲基-7-氧代苯并噻唑-2(3H)-亚基)-2-硫代噻唑烷-3-乙酸.
Category: Organic Chemicals.
Independent reference data for 4-oxo-5-(4,5,6,7-tetrahydro-3-methyl-7-oxobenzothiazol-2(3H)-ylidene)-2-thioxothiazolidin-3-acetic acid (CAS 30906-38-8), compiled from public chemistry databases.
| CAS 号 | 30906-38-8 |
|---|---|
| PubChem CID | 56841928 |
| 分子式 | C13H12N2O4S3 |
| IUPAC 名称 | 2-[(5E)-5-(3-methyl-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid |
| Molecular Weight | 356.4 |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 2 |
| Exact Mass | 355.99592039 |
| Monoisotopic Mass | 355.99592039 |
| Topological Polar Surface Area | 161 |
| Heavy Atom Count | 22 |
EINECS 250-384-0; 4-Oxo-5-(4,5,6,7-tetrahydro-3-methyl-7-oxobenzothiazol-2(3H)-ylidene)-2-thioxothiazolidin-3-acetic acid; 30906-38-8; LDIQMRFGJSIDCT-ZRDIBKRKSA-N
4-氧代-5-(4,5,6,7-四氢-3-甲基-7-氧代苯并噻唑-2(3H)-亚基)-2-硫代噻唑烷-3-乙酸 · CAS 30906-38-8 · C13H12N2O4S3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-氧代-5-(4,5,6,7-四氢-3-甲基-7-氧代苯并噻唑-2(3H)-亚基)-2-硫代噻唑烷-3-乙酸