Dibromomethane
PubChem CID: 3024
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| Compound Synonyms | dibromomethane, 74-95-3, Methylene bromide, Methane, dibromo-, Methylene dibromide, CH2Br2, Dibrommethan, Methylenbromid, RCRA waste number U068, Dibromomethylene, CCRIS 939, dibromo-methane, HSDB 1334, NSC 7293, EINECS 200-824-2, UN2664, 1,1-dibromomethane, BRN 0969143, DTXSID4021557, CHEBI:47077, AI3-52311, NSC-7293, MFCD00000168, V69B659W01, METHYLENE BROMIDE [MI], DTXCID401557, EC 200-824-2, 4-01-00-00078 (Beilstein Handbook Reference), 4371-77-1, MFCD00000169, RCRA waste no. U068, dibromo methane, Qmacd\qih, methane, dibromo, UNII-V69B659W01, Dibromomethane, 99%, Dibromomethane, >=99%, WLN: E1E, SCHEMBL20033, CHEMBL1229889, DTXSID10162481, NSC7293, Dibromomethane, analytical standard, Dibromomethane, stabilized with BHT, Tox21_200410, STL282729, AKOS009031545, Dibromomethane [UN2664] [Poison], FD61325, UN 2664, CAS-74-95-3, NCGC00248598-01, NCGC00257964-01, 2BM, SY350729, DB-029642, D0192, NS00005937, S0636, A15094, Q421736, F1908-0088, 200-824-2 |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 3.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 2.8 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | dibromomethane |
| Prediction Hob | 1.0 |
| Xlogp | 1.8 |
| Molecular Formula | CH2Br2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | FJBFPHVGVWTDIP-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | -1.269 |
| Rotatable Bond Count | 0.0 |
| Logd | 1.524 |
| Compound Name | Dibromomethane |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 173.85 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 171.852 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 173.83 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.076977 |
| Inchi | InChI=1S/CH2Br2/c2-1-3/h1H2 |
| Smiles | C(Br)Br |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Ainsliaea Dissecta (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Platycarphella Carlinoides (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Pulicaria Dysenterica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 4. Outgoing r'ship
FOUND_INto/from Uncaria Quadrangularis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all