4-(2-methylpent-2-en-3-yloxy)phenol

C12H16O2 — CID 123957504

IUPAC4-(2-methylpent-2-en-3-yloxy)phenol
SMILESCCC(Oc1ccc(O)cc1)=C(C)C
InChIInChI=1S/C12H16O2/c1-4-12(9(2)3)14-11-7-5-10(13)6-8-11/h5-8,13H,4H2,1-3H3
InChIKeyGQHCOVXABMOFFL-UHFFFAOYSA-N
MW192.26 g/mol
LogP3.47
Rot. Bonds3

About 4-(2-methylpent-2-en-3-yloxy)phenol

4-(2-methylpent-2-en-3-yloxy)phenol (PubChem CID 123957504) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is 4-(2-methylpent-2-en-3-yloxy)phenol.

Molecular Properties

Compound Name4-(2-methylpent-2-en-3-yloxy)phenol
PubChem CID123957504
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name4-(2-methylpent-2-en-3-yloxy)phenol
SMILESCCC(Oc1ccc(O)cc1)=C(C)C
InChIInChI=1S/C12H16O2/c1-4-12(9(2)3)14-11-7-5-10(13)6-8-11/h5-8,13H,4H2,1-3H3
InChIKeyGQHCOVXABMOFFL-UHFFFAOYSA-N
XLogP3.47
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

[4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenyl] acetate
CID 71316043
(4-hydroxyphenyl) 2-oxopropanoate
CID 22601056
4-(4-methyl-3-propoxypenta-1,3-dien-2-yl)oxyphenol
CID 142478081
(4-hydroxyphenyl) 2-methylbutanoate
CID 14573373
4-(1-cyclobutylideneethoxy)phenol
CID 171524220
dibutyltin;bis((4-hydroxyphenyl) acetate)
CID 67791458
(4-hydroxyphenyl) (4-propoxyphenyl) carbonate
CID 57144136
(4-hydroxyphenyl) 2-iodobutanoate
CID 126723622
4-[(2S)-2-methylbutoxy]phenol
CID 1490310
4-phenoxyphenol;propanoic acid
CID 67658817
[4-[1,2,2-tris(4-hydroxyphenyl)ethyl]phenyl] acetate
CID 139697360
bis(4-hydroxyphenyl) hexanedioate
CID 66769037

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpent-2-en-3-yloxy)phenol?
The IUPAC name of 4-(2-methylpent-2-en-3-yloxy)phenol (CID 123957504) is 4-(2-methylpent-2-en-3-yloxy)phenol.
What is the SMILES notation for 4-(2-methylpent-2-en-3-yloxy)phenol?
The canonical SMILES for 4-(2-methylpent-2-en-3-yloxy)phenol is CCC(Oc1ccc(O)cc1)=C(C)C.
What is the InChIKey of 4-(2-methylpent-2-en-3-yloxy)phenol?
The InChIKey is GQHCOVXABMOFFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2/c1-4-12(9(2)3)14-11-7-5-10(13)6-8-11/h5-8,13H,4H2,1-3H3.
What are the key properties of 4-(2-methylpent-2-en-3-yloxy)phenol?
4-(2-methylpent-2-en-3-yloxy)phenol has a molecular weight of 192.26 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpent-2-en-3-yloxy)phenol is sourced from PubChem (CID 123957504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).