(4-methylcyclopenta-1,3-dien-1-yl)methanol

C7H10O — CID 13460969

IUPAC(4-methylcyclopenta-1,3-dien-1-yl)methanol
SMILESCC1=CC=C(CO)C1
InChIInChI=1S/C7H10O/c1-6-2-3-7(4-6)5-8/h2-3,8H,4-5H2,1H3
InChIKeyLOLVPEPGRBCAQV-UHFFFAOYSA-N
MW110.16 g/mol
LogP1.26
Rot. Bonds1

About (4-methylcyclopenta-1,3-dien-1-yl)methanol

(4-methylcyclopenta-1,3-dien-1-yl)methanol (PubChem CID 13460969) has the molecular formula C7H10O and a molecular weight of 110.16 g/mol. Its IUPAC name is (4-methylcyclopenta-1,3-dien-1-yl)methanol.

Molecular Properties

Compound Name(4-methylcyclopenta-1,3-dien-1-yl)methanol
PubChem CID13460969
Molecular FormulaC7H10O
Molecular Weight110.16 g/mol
Exact Mass110.07
IUPAC Name(4-methylcyclopenta-1,3-dien-1-yl)methanol
SMILESCC1=CC=C(CO)C1
InChIInChI=1S/C7H10O/c1-6-2-3-7(4-6)5-8/h2-3,8H,4-5H2,1H3
InChIKeyLOLVPEPGRBCAQV-UHFFFAOYSA-N
XLogP1.26
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-Cyclopentene-1-methanol
CID 11051584
(2E)-3-Methylhex-2-en-1-ol
CID 5284494
(Z)-2-(4-methylpent-3-enyl)but-2-ene-1,4-diol
CID 14310718
2,4-Dimethyl-2E,4E-hexadien-1-ol
CID 13818518
4,5-Dihydroxy-2-methyl-1-methylcyclopent-3-ene
CID 11073425
(e)-2-(4-Methyl-3-pentenyl)-2-butene-1,4-diol
CID 14310719
(2E,6Z,10E)-6-(hydroxymethyl)-2,10-dimethyldodeca-2,6,10-triene-1,12-diol
CID 87477157
6-(Hydroxymethyl)-2,10-dimethyldodeca-2,6,10-triene-1,12-diol
CID 91054299
3-Methylhex-2-en-1-ol
CID 35482
2-Hepten-1-ol, 2-propyl-
CID 6365455
Unsaturated alcohol
CID 5280549
(Z)-2-ethylbut-2-en-1-ol
CID 6121908

Frequently Asked Questions

What is the IUPAC name of (4-methylcyclopenta-1,3-dien-1-yl)methanol?
The IUPAC name of (4-methylcyclopenta-1,3-dien-1-yl)methanol (CID 13460969) is (4-methylcyclopenta-1,3-dien-1-yl)methanol.
What is the SMILES notation for (4-methylcyclopenta-1,3-dien-1-yl)methanol?
The canonical SMILES for (4-methylcyclopenta-1,3-dien-1-yl)methanol is CC1=CC=C(CO)C1.
What is the InChIKey of (4-methylcyclopenta-1,3-dien-1-yl)methanol?
The InChIKey is LOLVPEPGRBCAQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O/c1-6-2-3-7(4-6)5-8/h2-3,8H,4-5H2,1H3.
What are the key properties of (4-methylcyclopenta-1,3-dien-1-yl)methanol?
(4-methylcyclopenta-1,3-dien-1-yl)methanol has a molecular weight of 110.16 g/mol, XLogP of 1.26, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylcyclopenta-1,3-dien-1-yl)methanol is sourced from PubChem (CID 13460969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).