(1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol

C15H24O — CID 91750191

IUPAC(1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol
SMILESCC12CC=C(CO)C(C1)C1(C)CCCC21C
InChIInChI=1S/C15H24O/c1-13-8-5-11(10-16)12(9-13)14(2)6-4-7-15(13,14)3/h5,12,16H,4,6-10H2,1-3H3
InChIKeyBOBUWMAINZVWRJ-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.53
Rot. Bonds1

About (1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol

(1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol (PubChem CID 91750191) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is (1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol.

Molecular Properties

Compound Name(1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol
PubChem CID91750191
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name(1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol
SMILESCC12CC=C(CO)C(C1)C1(C)CCCC21C
InChIInChI=1S/C15H24O/c1-13-8-5-11(10-16)12(9-13)14(2)6-4-7-15(13,14)3/h5,12,16H,4,6-10H2,1-3H3
InChIKeyBOBUWMAINZVWRJ-UHFFFAOYSA-N
XLogP3.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol?
The IUPAC name of (1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol (CID 91750191) is (1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol.
What is the SMILES notation for (1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol?
The canonical SMILES for (1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol is CC12CC=C(CO)C(C1)C1(C)CCCC21C.
What is the InChIKey of (1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol?
The InChIKey is BOBUWMAINZVWRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-13-8-5-11(10-16)12(9-13)14(2)6-4-7-15(13,14)3/h5,12,16H,4,6-10H2,1-3H3.
What are the key properties of (1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol?
(1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol has a molecular weight of 220.36 g/mol, XLogP of 3.53, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2,6-trimethyl-8-tricyclo[5.3.1.02,6]undec-8-enyl)methanol is sourced from PubChem (CID 91750191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).