Propan-2-one--water (1/1)

HCID 18366337CAS 18879-06-6
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Basic information

Standard SMILES
CC(C)=O.O
InChIKey
OVARTBFNCCXQKS-UHFFFAOYSA-N
Molecular formula
C3H8O2
Average molar mass
76.09 g/mol
Monoisotopic mass
76.0524295

Names & identifiers

Preferred name
Propan-2-one--water (1/1)
IUPAC
propan-2-one;hydrate

Names & synonyms

18879-06-6Propan-2-one--water (1/1)DTXSID80593162RefChem:373911DTXCID40543926acetone wateracetone-waterwater acetonewater-acetoneaceton waterwater acetonacetone H2O
Show more names
H2O acetoneCH3COCH3 H2OSCHEMBL362166OVARTBFNCCXQKS-UHFFFAOYSA-N

Database identifiers

CAS
18879-06-6
PubChem CID
18366337
DTXSID
DTXSID80593162

Properties

Computed structural properties

Topological polar surface area
18.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
5

Related reactions

532 records
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Linked notes

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