Introduction：Basic information about CAS 618-21-3|Benzoic acid,4-phosphono-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Benzoic acid,4-phosphono- |
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| CAS Number | 618-21-3 | Molecular Weight | 202.10100 |
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| Density | 1.65g/cm3 | Boiling Point | 489.1ºC at 760 mmHg |
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| Molecular Formula | C7H7O5P | Melting Point | 378 °C |
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| MSDS | / | Flash Point | 249.6ºC |
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Names
| Name | 4-phosphonobenzoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.65g/cm3 |
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| Boiling Point | 489.1ºC at 760 mmHg |
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| Melting Point | 378 °C |
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| Molecular Formula | C7H7O5P |
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| Molecular Weight | 202.10100 |
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| Flash Point | 249.6ºC |
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| Exact Mass | 202.00300 |
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| PSA | 104.64000 |
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| LogP | 0.18780 |
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| Index of Refraction | 1.619 |
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| InChIKey | IEQICHVXWFGDAN-UHFFFAOYSA-N |
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| SMILES | O=C(O)c1ccc(P(=O)(O)O)cc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DH6476150
- CHEMICAL NAME :
- Benzoic acid, (p-phosphono)-
- CAS REGISTRY NUMBER :
- 618-21-3
- BEILSTEIN REFERENCE NO. :
- 2938528
- LAST UPDATED :
- 199709
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C7-H7-O5-P
- MOLECULAR WEIGHT :
- 202.11
- WISWESSER LINE NOTATION :
- QVR DPQQO
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ANTCAO Antibiotics and Chemotherapy (Washington, DC). (Washington, DC) V.1-12, 1951-62. For publisher information, see CLMEA3. Volume(issue)/page/year: 3,256,1953
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Synonyms
