1-prop-2-enylanthracen-2-ol

C17H14O — CID 175294805

IUPAC1-prop-2-enylanthracen-2-ol
SMILESC=CCc1c(O)ccc2cc3ccccc3cc12
InChIInChI=1S/C17H14O/c1-2-5-15-16-11-13-7-4-3-6-12(13)10-14(16)8-9-17(15)18/h2-4,6-11,18H,1,5H2
InChIKeyQAOZKOIBLOEOIB-UHFFFAOYSA-N
MW234.30 g/mol
LogP4.43
Rot. Bonds2

About 1-prop-2-enylanthracen-2-ol

1-prop-2-enylanthracen-2-ol (PubChem CID 175294805) has the molecular formula C17H14O and a molecular weight of 234.30 g/mol. Its IUPAC name is 1-prop-2-enylanthracen-2-ol.

Molecular Properties

Compound Name1-prop-2-enylanthracen-2-ol
PubChem CID175294805
Molecular FormulaC17H14O
Molecular Weight234.30 g/mol
Exact Mass234.10
IUPAC Name1-prop-2-enylanthracen-2-ol
SMILESC=CCc1c(O)ccc2cc3ccccc3cc12
InChIInChI=1S/C17H14O/c1-2-5-15-16-11-13-7-4-3-6-12(13)10-14(16)8-9-17(15)18/h2-4,6-11,18H,1,5H2
InChIKeyQAOZKOIBLOEOIB-UHFFFAOYSA-N
XLogP4.43
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

1-prop-2-enyltetracene
CID 162689403
prop-2-enyl 6-hydroxy-5-prop-2-enylnaphthalene-2-carboxylate
CID 90322329
CID 89262500
CID 89262500
1-prop-1-enylanthracen-2-ol
CID 88685593
1-[(E)-but-2-enyl]naphthalen-2-ol
CID 11564655
octacyclo[16.16.0.02,15.04,13.06,11.020,33.022,31.024,29]tetratriaconta-1(34),2,4(13),5,7,9,11,14,16,18,20,22,24,26,28,30,32-heptadecaen-10-ol
CID 87638914
prop-2-enyl 6-hydroxy-5-prop-2-enylnaphthalene-2-carboxylate;prop-2-enyl 6-prop-2-enoxynaphthalene-2-carboxylate
CID 160520654
3-methoxy-1-prop-2-enylnaphthalen-2-ol
CID 130034062
heptacen-1-ol
CID 150633624
1,2,3,4,8,9,10,11-octakis(prop-2-enyl)pentacene
CID 173235726
3-benzyl-1-prop-2-enylnaphthalen-2-ol
CID 164665597
1-[(E)-3-anthracen-9-ylprop-1-enyl]naphthalen-2-ol
CID 102214824

Frequently Asked Questions

What is the IUPAC name of 1-prop-2-enylanthracen-2-ol?
The IUPAC name of 1-prop-2-enylanthracen-2-ol (CID 175294805) is 1-prop-2-enylanthracen-2-ol.
What is the SMILES notation for 1-prop-2-enylanthracen-2-ol?
The canonical SMILES for 1-prop-2-enylanthracen-2-ol is C=CCc1c(O)ccc2cc3ccccc3cc12.
What is the InChIKey of 1-prop-2-enylanthracen-2-ol?
The InChIKey is QAOZKOIBLOEOIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O/c1-2-5-15-16-11-13-7-4-3-6-12(13)10-14(16)8-9-17(15)18/h2-4,6-11,18H,1,5H2.
What are the key properties of 1-prop-2-enylanthracen-2-ol?
1-prop-2-enylanthracen-2-ol has a molecular weight of 234.30 g/mol, XLogP of 4.43, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-prop-2-enylanthracen-2-ol is sourced from PubChem (CID 175294805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).