Introduction：Basic information about CAS 61-24-5|Cephalosporin C, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Cephalosporin C |
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| CAS Number | 61-24-5 | Molecular Weight | 415.418 |
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| Density | 1.6±0.1 g/cm3 | Boiling Point | 814.7±65.0 °C at 760 mmHg |
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| Molecular Formula | C16H21N3O8S | Melting Point | / |
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| MSDS | / | Flash Point | 446.5±34.3 °C |
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Names
| Name | cephalosporin C |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.6±0.1 g/cm3 |
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| Boiling Point | 814.7±65.0 °C at 760 mmHg |
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| Molecular Formula | C16H21N3O8S |
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| Molecular Weight | 415.418 |
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| Flash Point | 446.5±34.3 °C |
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| Exact Mass | 415.104950 |
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| PSA | 205.12000 |
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| LogP | -0.20 |
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| Vapour Pressure | 0.0±6.3 mmHg at 25°C |
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| Index of Refraction | 1.639 |
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| InChIKey | HOKIDJSKDBPKTQ-GLXFQSAKSA-N |
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| SMILES | CC(=O)OCC1=C(C(=O)O)N2C(=O)C(NC(=O)CCCC(N)C(=O)O)C2SC1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- XI0331650
- CHEMICAL NAME :
- 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(5-amino-5-carboxyvaleramido)-3- (hydroxymethyl)-8-oxo-, acetate (ester)
- CAS REGISTRY NUMBER :
- 61-24-5
- BEILSTEIN REFERENCE NO. :
- 0065348
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C16-H21-N3-O8-S
- MOLECULAR WEIGHT :
- 415.46
- WISWESSER LINE NOTATION :
- T46 ANV ES GUTJ CMV3YZVQ G1OV1 HVQ
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 85GDA2 "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980- Volume(issue)/page/year: 4(1),96,1980 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-RUSSIA:STEL 0.3 mg/m3 JAN 1993
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Synonyms
| 4-27-00-05902 |
| cephalosphorin C |
| 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-7-[(5-amino-5-carboxy-1-oxopentyl)amino]-8-oxo-, (6R,7R)- |
| [6R-[6a,7b(R*)]]-3-[(Acetyloxy)methyl]-7-[(5-amino-5-carboxy-1-oxopentyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid |
| cephalosporn C |
| Centropazine |
| Cephalosporin |
| Cephalosporin C |
| (6R,7R)-3-(Acetoxymethyl)-7-[(5-amino-5-carboxypentanoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
| (6R,7R)-3-(Acetoxymethyl)-7-[(5-amino-5-carboxypentanoyl)amino]-8 -oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
| 7-(D-5-Amino-5-carboxyvaleramido)-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid Acetate |
| cefalosporin C |
| Centpropazine |
| (6R,7R)-3-[(acetyloxy)methyl]-7-[(5-amino-5-carboxypentanoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
