2-(4-ethenylphenyl)adamantan-2-ol

C18H22O — CID 118052026

IUPAC2-(4-ethenylphenyl)adamantan-2-ol
SMILESC=Cc1ccc(C2(O)C3CC4CC(C3)CC2C4)cc1
InChIInChI=1S/C18H22O/c1-2-12-3-5-15(6-4-12)18(19)16-8-13-7-14(10-16)11-17(18)9-13/h2-6,13-14,16-17,19H,1,7-11H2
InChIKeyJBKZQQBRXOVMPQ-UHFFFAOYSA-N
MW254.37 g/mol
LogP3.97
Rot. Bonds2

About 2-(4-ethenylphenyl)adamantan-2-ol

2-(4-ethenylphenyl)adamantan-2-ol (PubChem CID 118052026) has the molecular formula C18H22O and a molecular weight of 254.37 g/mol. Its IUPAC name is 2-(4-ethenylphenyl)adamantan-2-ol.

Molecular Properties

Compound Name2-(4-ethenylphenyl)adamantan-2-ol
PubChem CID118052026
Molecular FormulaC18H22O
Molecular Weight254.37 g/mol
Exact Mass254.17
IUPAC Name2-(4-ethenylphenyl)adamantan-2-ol
SMILESC=Cc1ccc(C2(O)C3CC4CC(C3)CC2C4)cc1
InChIInChI=1S/C18H22O/c1-2-12-3-5-15(6-4-12)18(19)16-8-13-7-14(10-16)11-17(18)9-13/h2-6,13-14,16-17,19H,1,7-11H2
InChIKeyJBKZQQBRXOVMPQ-UHFFFAOYSA-N
XLogP3.97
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-ethenylphenyl)adamantan-2-ol;methane
CID 159927256
[2-(4-hydroxyphenyl)-2-adamantyl] 4-ethenylbenzoate
CID 177265951
2-[4-(3-hydroxyphenyl)phenyl]adamantan-2-ol
CID 56957568
1-[3,5-bis(ethenyl)phenyl]-3-[4-[3-[3,5-bis(ethenyl)phenyl]-1-adamantyl]phenyl]adamantane
CID 91277770
[2-(2-hydroxyphenyl)-2-adamantyl] 4-ethenylbenzoate
CID 177265958
(2-methyl-2-adamantyl) 2-(4-ethenylphenoxy)acetate
CID 59227049
3-(4-ethenylphenyl)oxetan-3-ol
CID 156800872
2-(4-ethenyl-2-methoxyphenoxy)-2-methyladamantane
CID 169322067
1-[2-(4-ethenylphenyl)ethyl]cyclopropan-1-ol
CID 129180532
bromoethene;4-bromophenol;2-(4-bromophenoxy)-2-methyladamantane;2-(4-ethenylphenoxy)-2-methyladamantane;2-methylideneadamantane
CID 162102471
[2-(3-hydroxyphenyl)-2-bicyclo[2.2.1]heptanyl] 4-ethenylbenzoate
CID 177265976
2-(5-hydroxynaphthalen-1-yl)adamantan-2-ol
CID 59052123

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethenylphenyl)adamantan-2-ol?
The IUPAC name of 2-(4-ethenylphenyl)adamantan-2-ol (CID 118052026) is 2-(4-ethenylphenyl)adamantan-2-ol.
What is the SMILES notation for 2-(4-ethenylphenyl)adamantan-2-ol?
The canonical SMILES for 2-(4-ethenylphenyl)adamantan-2-ol is C=Cc1ccc(C2(O)C3CC4CC(C3)CC2C4)cc1.
What is the InChIKey of 2-(4-ethenylphenyl)adamantan-2-ol?
The InChIKey is JBKZQQBRXOVMPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O/c1-2-12-3-5-15(6-4-12)18(19)16-8-13-7-14(10-16)11-17(18)9-13/h2-6,13-14,16-17,19H,1,7-11H2.
What are the key properties of 2-(4-ethenylphenyl)adamantan-2-ol?
2-(4-ethenylphenyl)adamantan-2-ol has a molecular weight of 254.37 g/mol, XLogP of 3.97, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethenylphenyl)adamantan-2-ol is sourced from PubChem (CID 118052026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).