(6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol

C15H26O2 — CID 5321323

IUPAC(6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol
SMILESCC1CCC2CC3(OC2(C)C)C(CO)CCC13
InChIInChI=1S/C15H26O2/c1-10-4-5-11-8-15(17-14(11,2)3)12(9-16)6-7-13(10)15/h10-13,16H,4-9H2,1-3H3
InChIKeyABYYDYWFVSHNAX-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.99
Rot. Bonds1

About (6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol

(6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol (PubChem CID 5321323) has the molecular formula C15H26O2 and a molecular weight of 238.37 g/mol. Its IUPAC name is (6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol.

Molecular Properties

Compound Name(6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol
PubChem CID5321323
Molecular FormulaC15H26O2
Molecular Weight238.37 g/mol
Exact Mass238.19
IUPAC Name(6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol
SMILESCC1CCC2CC3(OC2(C)C)C(CO)CCC13
InChIInChI=1S/C15H26O2/c1-10-4-5-11-8-15(17-14(11,2)3)12(9-16)6-7-13(10)15/h10-13,16H,4-9H2,1-3H3
InChIKeyABYYDYWFVSHNAX-UHFFFAOYSA-N
XLogP2.99
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol?
The IUPAC name of (6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol (CID 5321323) is (6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol.
What is the SMILES notation for (6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol?
The canonical SMILES for (6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol is CC1CCC2CC3(OC2(C)C)C(CO)CCC13.
What is the InChIKey of (6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol?
The InChIKey is ABYYDYWFVSHNAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O2/c1-10-4-5-11-8-15(17-14(11,2)3)12(9-16)6-7-13(10)15/h10-13,16H,4-9H2,1-3H3.
What are the key properties of (6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol?
(6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol has a molecular weight of 238.37 g/mol, XLogP of 2.99, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,5]dodecan-2-yl)methanol is sourced from PubChem (CID 5321323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).