cyclopropylmethanol;formic acid

C5H10O3 — CID 174831416

IUPACcyclopropylmethanol;formic acid
SMILESO=CO.OCC1CC1
InChIInChI=1S/C4H8O.CH2O2/c5-3-4-1-2-4;2-1-3/h4-5H,1-3H2;1H,(H,2,3)
InChIKeyUMAZMAXTQIWPEF-UHFFFAOYSA-N
MW118.13 g/mol
LogP0.09
Rot. Bonds1

About cyclopropylmethanol;formic acid

cyclopropylmethanol;formic acid (PubChem CID 174831416) has the molecular formula C5H10O3 and a molecular weight of 118.13 g/mol. Its IUPAC name is cyclopropylmethanol;formic acid.

Molecular Properties

Compound Namecyclopropylmethanol;formic acid
PubChem CID174831416
Molecular FormulaC5H10O3
Molecular Weight118.13 g/mol
Exact Mass118.06
IUPAC Namecyclopropylmethanol;formic acid
SMILESO=CO.OCC1CC1
InChIInChI=1S/C4H8O.CH2O2/c5-3-4-1-2-4;2-1-3/h4-5H,1-3H2;1H,(H,2,3)
InChIKeyUMAZMAXTQIWPEF-UHFFFAOYSA-N
XLogP0.09
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.13
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

formic acid;[4-(hydroxymethyl)cyclohexyl]methanol
CID 158057171
4-(hydroxymethyl)cyclohexane-1-carbaldehyde
CID 523023
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CID 87532739
cyclohexane;[4-(hydroxymethyl)cyclohexyl]methanol;methanol
CID 19012640
[4-(hydroxymethyl)cyclohexyl]methanol;oxirane
CID 87065906
cyclopentanecarbaldehyde;cyclopentylmethanol
CID 161180132
[4-(hydroxymethyl)cyclohexyl]methyl 2-oxoacetate
CID 118444005
[(1S,7R)-4-bicyclo[5.1.0]octanyl]methanol
CID 130624155
(4-bromocyclohexyl)methanol
CID 20705723
[4-(hydroxymethylidene)cyclohexyl]methanol
CID 170737570
cyclotetradecylmethanol
CID 23468347
ethane;(4-methylcyclohexyl)methanol
CID 142233866

Frequently Asked Questions

What is the IUPAC name of cyclopropylmethanol;formic acid?
The IUPAC name of cyclopropylmethanol;formic acid (CID 174831416) is cyclopropylmethanol;formic acid.
What is the SMILES notation for cyclopropylmethanol;formic acid?
The canonical SMILES for cyclopropylmethanol;formic acid is O=CO.OCC1CC1.
What is the InChIKey of cyclopropylmethanol;formic acid?
The InChIKey is UMAZMAXTQIWPEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O.CH2O2/c5-3-4-1-2-4;2-1-3/h4-5H,1-3H2;1H,(H,2,3).
What are the key properties of cyclopropylmethanol;formic acid?
cyclopropylmethanol;formic acid has a molecular weight of 118.13 g/mol, XLogP of 0.09, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropylmethanol;formic acid is sourced from PubChem (CID 174831416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).