HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

(2E)-2-[(2-Hydroxyethyl)imino]propan-1-ol

HCID 57731141
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
80079-24-9
Standard SMILES
CC(CO)=NCCO
InChIKey
MPOLGKWWFPEZRZ-UHFFFAOYSA-N
Molecular formula
C5H11NO2
Average molar mass
117.15 g/mol
Monoisotopic mass
117.07897859

Names & identifiers

Preferred name
(2E)-2-[(2-Hydroxyethyl)imino]propan-1-ol
IUPAC
2-(2-hydroxyethylimino)propan-1-ol

Names & synonyms

80079-24-9(2E)-2-[(2-Hydroxyethyl)imino]propan-1-olSCHEMBL1624153SCHEMBL1624155SCHEMBL12720210DTXSID60727786

Database identifiers

CAS
80079-24-9
PubChem CID
57731141
DTXSID
DTXSID60727786

Properties

Computed structural properties

XLogP
-1.3
Topological polar surface area
52.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
8
Formal charge
0
Complexity
80.5

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes