1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol

C10H16O — CID 12610764

IUPAC1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol
SMILESCC12CCC(C=C1O)C2(C)C
InChIInChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h6-7,11H,4-5H2,1-3H3
InChIKeyQCSCVXPUXNDOGX-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.88
Rot. Bonds

About 1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol

1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol (PubChem CID 12610764) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol.

Molecular Properties

Compound Name1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol
PubChem CID12610764
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol
SMILESCC12CCC(C=C1O)C2(C)C
InChIInChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h6-7,11H,4-5H2,1-3H3
InChIKeyQCSCVXPUXNDOGX-UHFFFAOYSA-N
XLogP2.88
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol?
The IUPAC name of 1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol (CID 12610764) is 1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol.
What is the SMILES notation for 1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol?
The canonical SMILES for 1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol is CC12CCC(C=C1O)C2(C)C.
What is the InChIKey of 1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol?
The InChIKey is QCSCVXPUXNDOGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h6-7,11H,4-5H2,1-3H3.
What are the key properties of 1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol?
1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol has a molecular weight of 152.24 g/mol, XLogP of 2.88, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-ol is sourced from PubChem (CID 12610764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).