4-[4-(4-hydroxyphenyl)heptyl]phenol

C19H24O2 — CID 54154884

IUPAC4-[4-(4-hydroxyphenyl)heptyl]phenol
SMILESCCCC(CCCc1ccc(O)cc1)c1ccc(O)cc1
InChIInChI=1S/C19H24O2/c1-2-4-16(17-9-13-19(21)14-10-17)6-3-5-15-7-11-18(20)12-8-15/h7-14,16,20-21H,2-6H2,1H3
InChIKeyOKIFBZSWJHZAJA-UHFFFAOYSA-N
MW284.40 g/mol
LogP5.00
Rot. Bonds7

About 4-[4-(4-hydroxyphenyl)heptyl]phenol

4-[4-(4-hydroxyphenyl)heptyl]phenol (PubChem CID 54154884) has the molecular formula C19H24O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 4-[4-(4-hydroxyphenyl)heptyl]phenol.

Molecular Properties

Compound Name4-[4-(4-hydroxyphenyl)heptyl]phenol
PubChem CID54154884
Molecular FormulaC19H24O2
Molecular Weight284.40 g/mol
Exact Mass284.18
IUPAC Name4-[4-(4-hydroxyphenyl)heptyl]phenol
SMILESCCCC(CCCc1ccc(O)cc1)c1ccc(O)cc1
InChIInChI=1S/C19H24O2/c1-2-4-16(17-9-13-19(21)14-10-17)6-3-5-15-7-11-18(20)12-8-15/h7-14,16,20-21H,2-6H2,1H3
InChIKeyOKIFBZSWJHZAJA-UHFFFAOYSA-N
XLogP5.00
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.40
LogP ≤ 55.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-undecan-6-ylphenol
CID 66867197
4-hexadecan-7-ylphenol
CID 71320883
4-[6-(4-hydroxyphenyl)nonan-4-yl]phenol
CID 163777364
4-(4-propylphenyl)heptan-1-amine
CID 83921500
4-[4,4-bis(4-hydroxyphenyl)butyl]phenol
CID 56999686
4-butylphenol;tungsten
CID 174758928
4-octan-2-ylphenol;4-octylphenol
CID 157081049
1-ethyl-4-undecan-4-ylbenzene
CID 14568440
4-dodecan-3-ylphenol
CID 12820022
4-[2-(4-pentylphenyl)ethyl]phenol
CID 57152203
lithium;4-butylphenol;hydride
CID 174758234
4-(3,5-dimethyloctyl)phenol
CID 174906830

Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-hydroxyphenyl)heptyl]phenol?
The IUPAC name of 4-[4-(4-hydroxyphenyl)heptyl]phenol (CID 54154884) is 4-[4-(4-hydroxyphenyl)heptyl]phenol.
What is the SMILES notation for 4-[4-(4-hydroxyphenyl)heptyl]phenol?
The canonical SMILES for 4-[4-(4-hydroxyphenyl)heptyl]phenol is CCCC(CCCc1ccc(O)cc1)c1ccc(O)cc1.
What is the InChIKey of 4-[4-(4-hydroxyphenyl)heptyl]phenol?
The InChIKey is OKIFBZSWJHZAJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O2/c1-2-4-16(17-9-13-19(21)14-10-17)6-3-5-15-7-11-18(20)12-8-15/h7-14,16,20-21H,2-6H2,1H3.
What are the key properties of 4-[4-(4-hydroxyphenyl)heptyl]phenol?
4-[4-(4-hydroxyphenyl)heptyl]phenol has a molecular weight of 284.40 g/mol, XLogP of 5.00, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-hydroxyphenyl)heptyl]phenol is sourced from PubChem (CID 54154884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).