Hexamethylphosphoramide
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CAS Number 680-31-9
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Catalog Number io-2491
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Classification Acids
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Molecular Weight 179.2000
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SMILES CN(C)P(=O)(N(C)C)N(C)C
| Size | QTY | Notes | |
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Hexamethylphosphoramide can cause cancer according to an independent committee of scientific and health experts. It can cause male reproductive toxicity according to The Environmental Protection Agency (EPA).
| 1 | HEXAMETHYLPHOSPHORAMIDE |
| 2 | HMPA |
| 3 | Hexamethylphosphoric triamide |
| 4 | Hexametapol |
| 5 | Hempa |
| Molecular Formula | C6H18N3OP |
|---|---|
| Canonical SMILES | CN(C)P(=O)(N(C)C)N(C)C |
| Isomeric SMILES | CN(C)P(=O)(N(C)C)N(C)C |
| Molecular Weight | 179.2000 |
| InChIKey | GNOIPBMMFNIUFM-UHFFFAOYSA-N |
| InChI | InChI=1S/C6H18N3OP/c1-7(2)11(10,8(3)4)9(5)6/h1-6H3 |
| XLogP | 0.3000 |
| ExactMass | 179.1187 |
| MonoisotopicMass | 179.1187 |
| TPSA | 26.8000 |
| Complexity | 139.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 4 |
| RotatableBondCount | 3 |
| HeavyAtomCount | 11 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 59098 |
| PatentFamilyCount | 23860 |
| LiteratureCount | 3744 |
