MBR
TRIBROMOMETHANE
| Created: | 1999-07-08 |
| Last modified: | 2014-09-12 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 5 |
| Chiral Atom Count | 0 |
| Bond Count | 4 |
| Aromatic Bond Count | 0 |
Chemical Component Summary | |
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| Name | TRIBROMOMETHANE |
| Systematic Name (OpenEye OEToolkits) | tribromomethane |
| Formula | C H Br3 |
| Molecular Weight | 252.731 |
| Type | NON-POLYMER |
Chemical Descriptors | |||
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| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | BrC(Br)Br |
| SMILES | CACTVS | 3.341 | BrC(Br)Br |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(Br)(Br)Br |
| Canonical SMILES | CACTVS | 3.341 | BrC(Br)Br |
| Canonical SMILES | OpenEye OEToolkits | 1.5.0 | C(Br)(Br)Br |
| InChI | InChI | 1.03 | InChI=1S/CHBr3/c2-1(3)4/h1H |
| InChIKey | InChI | 1.03 | DIKBFYAXUHHXCS-UHFFFAOYSA-N |
Drug Info: DrugBank
| DrugBank ID | DB03054 |
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| Name | Bromoform |
| Groups | experimental |
| Synonyms |
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| Categories |
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| CAS number | 75-25-2 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 5558 |
| ChEMBL | CHEMBL345248 |
| ChEBI | CHEBI:38682 |
| CCDC/CSD | SEHJIA, LIHMIB, SEHJIA01, SEHJIA02, BROFRM06, RERBEW, CIFZOJ, AGEHOL, JEVZAL, JEVZAL10, SEHJAS, LIHMAT, BROFRM05, EVENOK, NOLLEG, HEKYED, ANAZUM, MOYVIH, HOZNIV, IXUJAO, KUCBAL, VESVEV, IXUJES, QOWCOU, BFHMTA, YAVPEQ, SEHJEW, OQULAQ, QARJOM, CAVKAP, RAQBAQ |
| COD | 1504397, 1504396 |
