2-hydroxyacetic acid;prop-1-ene

C5H10O3 — CID 19035670

IUPAC2-hydroxyacetic acid;prop-1-ene
SMILESC=CC.O=C(O)CO
InChIInChI=1S/C3H6.C2H4O3/c1-3-2;3-1-2(4)5/h3H,1H2,2H3;3H,1H2,(H,4,5)
InChIKeyQGVQOXWNOSEKGM-UHFFFAOYSA-N
MW118.13 g/mol
LogP0.26
Rot. Bonds1

About 2-hydroxyacetic acid;prop-1-ene

2-hydroxyacetic acid;prop-1-ene (PubChem CID 19035670) has the molecular formula C5H10O3 and a molecular weight of 118.13 g/mol. Its IUPAC name is 2-hydroxyacetic acid;prop-1-ene.

Molecular Properties

Compound Name2-hydroxyacetic acid;prop-1-ene
PubChem CID19035670
Molecular FormulaC5H10O3
Molecular Weight118.13 g/mol
Exact Mass118.06
IUPAC Name2-hydroxyacetic acid;prop-1-ene
SMILESC=CC.O=C(O)CO
InChIInChI=1S/C3H6.C2H4O3/c1-3-2;3-1-2(4)5/h3H,1H2,2H3;3H,1H2,(H,4,5)
InChIKeyQGVQOXWNOSEKGM-UHFFFAOYSA-N
XLogP0.26
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 ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-hydroxyacetic acid;tris(prop-1-ene)
CID 159374774
ethane-1,2-diol;prop-1-ene;bis(2-sulfanylacetic acid)
CID 174510482
2-hydroxyacetic acid;prop-2-ene-1-thiol
CID 88789188
carbonic acid;prop-1-ene;trihydrofluoride
CID 174985064
carbonic acid;phosphane;prop-1-ene
CID 174648548
CID 88684247
CID 88684247
tetrakis(2-hydroxyacetic acid);silane
CID 173225780
bis(2-hydroxyacetic acid);methane
CID 158039555
2-hydroxyacetic acid;N-methylprop-2-enamide
CID 87472265
2-hydroxyacetic acid;methoxymethane
CID 87581490
acetic acid;carbonic acid;prop-1-ene
CID 87718804
bis(prop-1-ene);prop-2-enoic acid
CID 118194844

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyacetic acid;prop-1-ene?
The IUPAC name of 2-hydroxyacetic acid;prop-1-ene (CID 19035670) is 2-hydroxyacetic acid;prop-1-ene.
What is the SMILES notation for 2-hydroxyacetic acid;prop-1-ene?
The canonical SMILES for 2-hydroxyacetic acid;prop-1-ene is C=CC.O=C(O)CO.
What is the InChIKey of 2-hydroxyacetic acid;prop-1-ene?
The InChIKey is QGVQOXWNOSEKGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6.C2H4O3/c1-3-2;3-1-2(4)5/h3H,1H2,2H3;3H,1H2,(H,4,5).
What are the key properties of 2-hydroxyacetic acid;prop-1-ene?
2-hydroxyacetic acid;prop-1-ene has a molecular weight of 118.13 g/mol, XLogP of 0.26, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyacetic acid;prop-1-ene is sourced from PubChem (CID 19035670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).