Cefotiam Hexetil Hydrochloride
Product Description
| Product | Cefotiam Hexetil Hydrochloride |
| CAS | 95789-30-3 |
| Formula | C27H39Cl2N9O7S3 |
| Synonym | Cefotiam hexetil HCl, Cefotiam hexetil hydrochloride, CTM-HE, UNII-3N1X7E8CLE, Systematic Name 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2-amino-4-thiazolyl)acetyl)amino)-3-(((1-(2-(dimethylamino)ethyl)-1H-tetrazol-5-yl)thio)methyl)-8-oxo-, 1-(((cyclohexyloxy)carbonyl)oxy)ethyl ester, dihydrochloride, (6R-(6-alpha,7-beta))-, Registry Numbers CAS Registry Number 95789-30-3, FDA UNII 3N1X7E8CLE, System Generated Number 0095789303, Molecular Formulas ?Molecular Formula C27-H37-N9-O7-S3.2Cl-H, Molecular Formula Fragments C27-H37-N9-O7-S3, Cl-H, COMPONENT |
Typical Product Specifications
| Molecular weight | 768.77 |
| SMILES | Cl.Cl.CC(OC(=O)OC1CCCCC1)OC(=O)C2=C(CSc3nnnn3CCN(C)C)CS[C@@H]4[C@H](NC(=O)Cc5csc(N)n5)C(=O)N24 |
| Molecular weight | 404.93 |
| SMILES | C12=CC(=O)CC[C@@]1([C@@H]1[C@@H](C=C2Cl)[C@H]2[C@@]([C@@](CC2)(OC(=O)C)C(=O)C)(CC1)C)C |
| InChI | 1S/C23H29ClO4/c1-13(25)23(28-14(2)26)10-7-18-16-12-20(24)19-11-15(27)5-8-21(19,3)17(16)6-9-22(18,23)4/h11-12,16-18H,5-10H2,1-4H3 |
| Atmospheric OH Rate Constant | 7.04E-11 cm3/molecule-sec |
| Melting Point | 213 ° C |
| log P (octanol-water) | 3.950 |
| Class | Specialty Chemicals |
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