Methylazoxymethanol
PubChem CID: 6433205
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| Compound Synonyms | METHYLAZOXYMETHANOL, 590-96-5, methazoxymethanol, Methanol, (methyl-ONN-azoxy)-, JGG19N3YDQ, (methyl-ONN-azoxy)methanol, CCRIS 1113, HSDB 3509, methyl-ONN-azoxymethanol, BRN 1921057, 1-Hydroxymethyl-2-methylditmide-2-oxide, (Z)-hydroxymethylimino-methyl-oxidoazanium, CH3-N(O)=N-CH2OH, CHEBI:29323, METHANOL, (METHYLAZOXY)-, METHYLAZOXYMETHANOL [HSDB], METHANOL, 1-(2-METHYL-2-OXIDODIAZENYL)-, UNII-JGG19N3YDQ, DTXSID1035076, Methanol, (methylONNazoxy), DTXCID9015076, 1Hydroxymethyl2methyldiimide2oxide, C02390 |
|---|---|
| Topological Polar Surface Area | 61.3 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 6.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 60.6 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (Z)-hydroxymethylimino-methyl-oxidoazanium |
| Nih Violation | True |
| Prediction Hob | 1.0 |
| Xlogp | -0.8 |
| Is Pains | True |
| Molecular Formula | C2H6N2O2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | BJNBRIBHKLJMAG-ARJAWSKDSA-N |
| Fcsp3 | 1.0 |
| Rotatable Bond Count | 1.0 |
| Compound Name | Methylazoxymethanol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 90.0429 |
| Formal Charge | 0.0 |
| Brenk Violation | True |
| Monoisotopic Mass | 90.0429 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 90.08 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Esol | 0.19039160000000016 |
| Inchi | InChI=1S/C2H6N2O2/c1-4(6)3-2-5/h5H,2H2,1H3/b4-3- |
| Smiles | C/[N+](=N/CO)/[O-] |
| Defined Bond Stereocenter Count | 1.0 |
- 1. Outgoing r'ship
FOUND_INto/from Cycas Revoluta (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Nelumbo Nucifera (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Ziziphus Jujuba (Plant) Rel Props:Source_db:cmaup_ingredients