2-hydroxypropanoic acid;tetrahydrate

C3H14O7 — CID 141343914

IUPAC2-hydroxypropanoic acid;tetrahydrate
SMILESCC(O)C(=O)O.O.O.O.O
InChIInChI=1S/C3H6O3.4H2O/c1-2(4)3(5)6;;;;/h2,4H,1H3,(H,5,6);4*1H2
InChIKeyYXCVDOGQPHVLGO-UHFFFAOYSA-N
MW162.14 g/mol
LogP-3.85
Rot. Bonds1

About 2-hydroxypropanoic acid;tetrahydrate

2-hydroxypropanoic acid;tetrahydrate (PubChem CID 141343914) has the molecular formula C3H14O7 and a molecular weight of 162.14 g/mol. Its IUPAC name is 2-hydroxypropanoic acid;tetrahydrate.

Molecular Properties

Compound Name2-hydroxypropanoic acid;tetrahydrate
PubChem CID141343914
Molecular FormulaC3H14O7
Molecular Weight162.14 g/mol
Exact Mass162.07
IUPAC Name2-hydroxypropanoic acid;tetrahydrate
SMILESCC(O)C(=O)O.O.O.O.O
InChIInChI=1S/C3H6O3.4H2O/c1-2(4)3(5)6;;;;/h2,4H,1H3,(H,5,6);4*1H2
InChIKeyYXCVDOGQPHVLGO-UHFFFAOYSA-N
XLogP-3.85
TPSA183.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.14
LogP ≤ 5-3.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-hydroxypropanoic acid;tetrahydrate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Calciumlactatepentahydrate
CID 87103201
azane;bis(2-hydroxypropanoic acid);dihydrate
CID 175182487
chromium;2-hydroxypropanoic acid;trihydrate
CID 173468651
2-hydroxypropanoic acid
CID 87075455
calcium;hydride;2-hydroxypropanoic acid;tetrahydrate
CID 173372729
calcium;hydride;2-hydroxypropanoic acid;dihydrate
CID 173144735
CID 123133976
CID 123133976
CID 131877347
CID 131877347
pentaheptacontacalcium;(2-hydroxypropanoic acid)
CID 173046474
calcium hexakis(2-hydroxypropanoic acid)
CID 162368187
2-hydroxypropanoic acid;mercury
CID 88512020
CID 11776805
CID 11776805

Frequently Asked Questions

What is the IUPAC name of 2-hydroxypropanoic acid;tetrahydrate?
The IUPAC name of 2-hydroxypropanoic acid;tetrahydrate (CID 141343914) is 2-hydroxypropanoic acid;tetrahydrate.
What is the SMILES notation for 2-hydroxypropanoic acid;tetrahydrate?
The canonical SMILES for 2-hydroxypropanoic acid;tetrahydrate is CC(O)C(=O)O.O.O.O.O.
What is the InChIKey of 2-hydroxypropanoic acid;tetrahydrate?
The InChIKey is YXCVDOGQPHVLGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6O3.4H2O/c1-2(4)3(5)6;;;;/h2,4H,1H3,(H,5,6);4*1H2.
What are the key properties of 2-hydroxypropanoic acid;tetrahydrate?
2-hydroxypropanoic acid;tetrahydrate has a molecular weight of 162.14 g/mol, XLogP of -3.85, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxypropanoic acid;tetrahydrate is sourced from PubChem (CID 141343914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).