Methanediol, methoxy-

HCID 5231663CAS 34405-39-5

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Basic information

Standard SMILES: COC(O)O
InChIKey: YENFRIPPRDTIBH-UHFFFAOYSA-N
Molecular formula: C2H6O3
Average molar mass: 78.07 g/mol
Monoisotopic mass: 78.03169405

Names & identifiers

Preferred name: Methanediol, methoxy-
IUPAC: methoxymethanediol

Names & synonyms

Methanediol, methoxy-DTXSID3041184234405-39-5RefChem:352180DTXCID40362694MethoxymethanediolOrthoameisensauremethylatherSCHEMBL93321SCHEMBL289977SCHEMBL7523401SCHEMBL28168767YENFRIPPRDTIBH-UHFFFAOYSA-N

Database identifiers

CAS: 34405-39-5
PubChem CID: 5231663
DTXSID: DTXSID30411842

Properties

Computed structural properties

XLogP: -1
Topological polar surface area: 49.7 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 5
Formal charge: 0
Complexity: 18.9

Related reactions

1 records

New reaction record

HRID 1576988As reactantuspto-grants-1976_09

Linked notes

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