(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol

C10H16O — CID 13231647

IUPAC(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol
SMILESCC1=C(C)C(CO)C(C)=C1C
InChIInChI=1S/C10H16O/c1-6-7(2)9(4)10(5-11)8(6)3/h10-11H,5H2,1-4H3
InChIKeyQQXIUMFWBXRMSC-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.28
Rot. Bonds1

About (2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol

(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol (PubChem CID 13231647) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is (2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol.

Molecular Properties

Compound Name(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol
PubChem CID13231647
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol
SMILESCC1=C(C)C(CO)C(C)=C1C
InChIInChI=1S/C10H16O/c1-6-7(2)9(4)10(5-11)8(6)3/h10-11H,5H2,1-4H3
InChIKeyQQXIUMFWBXRMSC-UHFFFAOYSA-N
XLogP2.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol?
The IUPAC name of (2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol (CID 13231647) is (2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol.
What is the SMILES notation for (2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol?
The canonical SMILES for (2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol is CC1=C(C)C(CO)C(C)=C1C.
What is the InChIKey of (2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol?
The InChIKey is QQXIUMFWBXRMSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-6-7(2)9(4)10(5-11)8(6)3/h10-11H,5H2,1-4H3.
What are the key properties of (2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol?
(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol has a molecular weight of 152.24 g/mol, XLogP of 2.28, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)methanol is sourced from PubChem (CID 13231647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).