1,1,3,3-tetracyclopropylpropane-1,3-diol

C15H24O2 — CID 15896976

IUPAC1,1,3,3-tetracyclopropylpropane-1,3-diol
SMILESOC(CC(O)(C1CC1)C1CC1)(C1CC1)C1CC1
InChIInChI=1S/C15H24O2/c16-14(10-1-2-10,11-3-4-11)9-15(17,12-5-6-12)13-7-8-13/h10-13,16-17H,1-9H2
InChIKeyUMVKUZXWAWHMEQ-UHFFFAOYSA-N
MW236.35 g/mol
LogP2.48
Rot. Bonds6

About 1,1,3,3-tetracyclopropylpropane-1,3-diol

1,1,3,3-tetracyclopropylpropane-1,3-diol (PubChem CID 15896976) has the molecular formula C15H24O2 and a molecular weight of 236.35 g/mol. Its IUPAC name is 1,1,3,3-tetracyclopropylpropane-1,3-diol.

Molecular Properties

Compound Name1,1,3,3-tetracyclopropylpropane-1,3-diol
PubChem CID15896976
Molecular FormulaC15H24O2
Molecular Weight236.35 g/mol
Exact Mass236.18
IUPAC Name1,1,3,3-tetracyclopropylpropane-1,3-diol
SMILESOC(CC(O)(C1CC1)C1CC1)(C1CC1)C1CC1
InChIInChI=1S/C15H24O2/c16-14(10-1-2-10,11-3-4-11)9-15(17,12-5-6-12)13-7-8-13/h10-13,16-17H,1-9H2
InChIKeyUMVKUZXWAWHMEQ-UHFFFAOYSA-N
XLogP2.48
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.35
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,1,3,3-tetracyclopropylpropane-1,3-diol?
The IUPAC name of 1,1,3,3-tetracyclopropylpropane-1,3-diol (CID 15896976) is 1,1,3,3-tetracyclopropylpropane-1,3-diol.
What is the SMILES notation for 1,1,3,3-tetracyclopropylpropane-1,3-diol?
The canonical SMILES for 1,1,3,3-tetracyclopropylpropane-1,3-diol is OC(CC(O)(C1CC1)C1CC1)(C1CC1)C1CC1.
What is the InChIKey of 1,1,3,3-tetracyclopropylpropane-1,3-diol?
The InChIKey is UMVKUZXWAWHMEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O2/c16-14(10-1-2-10,11-3-4-11)9-15(17,12-5-6-12)13-7-8-13/h10-13,16-17H,1-9H2.
What are the key properties of 1,1,3,3-tetracyclopropylpropane-1,3-diol?
1,1,3,3-tetracyclopropylpropane-1,3-diol has a molecular weight of 236.35 g/mol, XLogP of 2.48, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3-tetracyclopropylpropane-1,3-diol is sourced from PubChem (CID 15896976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).