trans-(1R,2R)-cyclopropane-1,2-diol

C3H6O2 — CID 59075452

IUPACtrans-(1R,2R)-cyclopropane-1,2-diol
SMILESO[C@@H]1C[C@H]1O
InChIInChI=1S/C3H6O2/c4-2-1-3(2)5/h2-5H,1H2/t2-,3-/m1/s1
InChIKeyBTWIMZVCLMHNAV-PWNYCUMCSA-N
MW74.08 g/mol
LogP-0.89
Rot. Bonds

About trans-(1R,2R)-cyclopropane-1,2-diol

trans-(1R,2R)-cyclopropane-1,2-diol (PubChem CID 59075452) has the molecular formula C3H6O2 and a molecular weight of 74.08 g/mol. Its IUPAC name is trans-(1R,2R)-cyclopropane-1,2-diol.

Molecular Properties

Compound Nametrans-(1R,2R)-cyclopropane-1,2-diol
PubChem CID59075452
Molecular FormulaC3H6O2
Molecular Weight74.08 g/mol
Exact Mass74.04
IUPAC Nametrans-(1R,2R)-cyclopropane-1,2-diol
SMILESO[C@@H]1C[C@H]1O
InChIInChI=1S/C3H6O2/c4-2-1-3(2)5/h2-5H,1H2/t2-,3-/m1/s1
InChIKeyBTWIMZVCLMHNAV-PWNYCUMCSA-N
XLogP-0.89
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50074.08
LogP ≤ 5-0.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-cyclopropane-1,2-diol?
The IUPAC name of trans-(1R,2R)-cyclopropane-1,2-diol (CID 59075452) is trans-(1R,2R)-cyclopropane-1,2-diol.
What is the SMILES notation for trans-(1R,2R)-cyclopropane-1,2-diol?
The canonical SMILES for trans-(1R,2R)-cyclopropane-1,2-diol is O[C@@H]1C[C@H]1O.
What is the InChIKey of trans-(1R,2R)-cyclopropane-1,2-diol?
The InChIKey is BTWIMZVCLMHNAV-PWNYCUMCSA-N. The full InChI is InChI=1S/C3H6O2/c4-2-1-3(2)5/h2-5H,1H2/t2-,3-/m1/s1.
What are the key properties of trans-(1R,2R)-cyclopropane-1,2-diol?
trans-(1R,2R)-cyclopropane-1,2-diol has a molecular weight of 74.08 g/mol, XLogP of -0.89, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-cyclopropane-1,2-diol is sourced from PubChem (CID 59075452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).