Basic information
- CAS
22693-65-8- Standard SMILES
N=C(N)C(O)c1ccc2c(c1)OCO2- InChIKey
DPOREOOGDLINFI-UHFFFAOYSA-N- Molecular formula
- C9H10N2O3
- Average molar mass
- 194.19 g/mol
- Monoisotopic mass
- 194.06914219
Overview
RN given refers to cpd without isomeric designation; structure
Names & identifiers
- Preferred name
- Olmidine
- IUPAC
- 2-(1,3-benzodioxol-5-yl)-2-hydroxyethanimidamide
- English name
- Olmidine
- Molecular formula
- C9H10N2O3
- Molecular weight
- 194.189
Names & synonyms
Olmidine22693-65-8Dl-olmidine3,4-(Methylenedioxy)mandelamidine0T3B934Y1Malpha-Hydroxy-1,3-benzodioxole-5-ethanimidamideDL-2-(3,4-methylenedioxyphenyl)-2-hydroxyacetamidineRefChem:928185Olmidina31105-14-3Olmidine, (+)-Olmidine, (-)-
Show more names
1,3-Benzodioxole-5-(α-hydroxyacetamidine)
2-(2H-1,3-benzodioxol-5-yl)-2-hydroxyethanimidamideCWA7D4VAX82-(1,3-benzodioxol-5-yl)-2-hydroxyethanimidamide2-(1,3-dioxaindan-5-yl)-2-hydroxyethanimidamide6X082H783COlimidineLL 141846319-96-4
Database identifiers
- CAS
22693-65-8、46319-96-4、788094-87-1- PubChem CID
- 31491
- DTXSID
DTXSID90865064- ChEMBL
CHEMBL2104702- UNII
- 0T3B934Y1M、6X082H783C、CWA7D4VAX8
- Nikkaji
- J11.485E
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 88.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 234
Physicochemical properties
- FDA UNII
- 0 T3B934Y1M · 0T3B934Y1M
Chemistry & industry
Suppliers4 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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