4-(4-hydroxyphenyl)phenol;1,10-phenanthroline

C24H18N2O2 — CID 139054123

IUPAC4-(4-hydroxyphenyl)phenol;1,10-phenanthroline
SMILESOc1ccc(-c2ccc(O)cc2)cc1.c1cnc2c(c1)ccc1cccnc12
InChIInChI=1S/C12H8N2.C12H10O2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H;1-8,13-14H
InChIKeyLWPQPBZHQFRRMM-UHFFFAOYSA-N
MW366.42 g/mol
LogP5.55
Rot. Bonds1

About 4-(4-hydroxyphenyl)phenol;1,10-phenanthroline

4-(4-hydroxyphenyl)phenol;1,10-phenanthroline (PubChem CID 139054123) has the molecular formula C24H18N2O2 and a molecular weight of 366.42 g/mol. Its IUPAC name is 4-(4-hydroxyphenyl)phenol;1,10-phenanthroline.

Molecular Properties

Compound Name4-(4-hydroxyphenyl)phenol;1,10-phenanthroline
PubChem CID139054123
Molecular FormulaC24H18N2O2
Molecular Weight366.42 g/mol
Exact Mass366.14
IUPAC Name4-(4-hydroxyphenyl)phenol;1,10-phenanthroline
SMILESOc1ccc(-c2ccc(O)cc2)cc1.c1cnc2c(c1)ccc1cccnc12
InChIInChI=1S/C12H8N2.C12H10O2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H;1-8,13-14H
InChIKeyLWPQPBZHQFRRMM-UHFFFAOYSA-N
XLogP5.55
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.42
LogP ≤ 55.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

9-(4-Hydroxyphenyl)-2,7-Phenanthroline
CID 447874
Unii-8KG95Q2dqh
CID 25268906
2-[(Quinolin-8-ylamino)methyl]phenol
CID 890662
Phenol, p-[2-(4-quinolyl)vinyl]-
CID 741423
5-[(8-Hydroxyquinolin-5-yl)methyl]quinolin-8-ol
CID 761547
4-Quinoxalin-2-ylphenol
CID 787366
3-Methyl-4-quinoxalin-2-ylphenol
CID 659650
3-Pyridin-4-yl-quinolin-7-ol
CID 135449022
4-[5-(Piperidin-3-ylamino)isoquinolin-7-yl]phenol
CID 156018227
4-Methyl-2-[(quinolin-8-ylamino)methyl]phenol
CID 929817
4-Methyl-2-[(quinolin-3-ylamino)methyl]phenol
CID 951116
Dibenzo[f,h]quinolin-7-ol
CID 219962

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxyphenyl)phenol;1,10-phenanthroline?
The IUPAC name of 4-(4-hydroxyphenyl)phenol;1,10-phenanthroline (CID 139054123) is 4-(4-hydroxyphenyl)phenol;1,10-phenanthroline.
What is the SMILES notation for 4-(4-hydroxyphenyl)phenol;1,10-phenanthroline?
The canonical SMILES for 4-(4-hydroxyphenyl)phenol;1,10-phenanthroline is Oc1ccc(-c2ccc(O)cc2)cc1.c1cnc2c(c1)ccc1cccnc12.
What is the InChIKey of 4-(4-hydroxyphenyl)phenol;1,10-phenanthroline?
The InChIKey is LWPQPBZHQFRRMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2.C12H10O2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H;1-8,13-14H.
What are the key properties of 4-(4-hydroxyphenyl)phenol;1,10-phenanthroline?
4-(4-hydroxyphenyl)phenol;1,10-phenanthroline has a molecular weight of 366.42 g/mol, XLogP of 5.55, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxyphenyl)phenol;1,10-phenanthroline is sourced from PubChem (CID 139054123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).