2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol

C12H16O2 — CID 118140907

IUPAC2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol
SMILESC=C(CO)c1cccc(OC(C)C)c1
InChIInChI=1S/C12H16O2/c1-9(2)14-12-6-4-5-11(7-12)10(3)8-13/h4-7,9,13H,3,8H2,1-2H3
InChIKeyKDSDGLJCEHVKLB-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.48
Rot. Bonds4

About 2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol

2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol (PubChem CID 118140907) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol.

Molecular Properties

Compound Name2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol
PubChem CID118140907
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol
SMILESC=C(CO)c1cccc(OC(C)C)c1
InChIInChI=1S/C12H16O2/c1-9(2)14-12-6-4-5-11(7-12)10(3)8-13/h4-7,9,13H,3,8H2,1-2H3
InChIKeyKDSDGLJCEHVKLB-UHFFFAOYSA-N
XLogP2.48
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-propan-2-yloxyphenyl)but-3-en-1-one
CID 116659453
N-propan-2-yl-3-propan-2-yloxybenzamide
CID 8779048
3-amino-1-(3-propan-2-yloxyphenyl)butan-1-one
CID 116555955
2-hydroxy-1-(3-propan-2-yloxyphenyl)butan-1-one
CID 103453162
1-(3-propan-2-yloxyphenyl)ethanimine
CID 144635422
4,4-dimethyl-1-(3-propan-2-yloxyphenyl)pentan-1-one
CID 114970108
butan-2-yl 3-propan-2-yloxybenzoate
CID 82186277
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-3-propan-2-yloxybenzamide
CID 107866608
4-oxo-4-(3-propan-2-yloxyphenyl)butanenitrile
CID 61213015
2-[(2-methylpropan-2-yl)oxy]-1-(3-propan-2-yloxyphenyl)ethanone
CID 105120452
4-bromo-1-(3-propan-2-yloxyphenyl)butan-1-one
CID 146007117
3-ethyl-1-(3-propan-2-yloxyphenyl)pent-2-en-1-one
CID 103458915

Frequently Asked Questions

What is the IUPAC name of 2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol?
The IUPAC name of 2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol (CID 118140907) is 2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol.
What is the SMILES notation for 2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol?
The canonical SMILES for 2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol is C=C(CO)c1cccc(OC(C)C)c1.
What is the InChIKey of 2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol?
The InChIKey is KDSDGLJCEHVKLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2/c1-9(2)14-12-6-4-5-11(7-12)10(3)8-13/h4-7,9,13H,3,8H2,1-2H3.
What are the key properties of 2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol?
2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol has a molecular weight of 192.26 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-propan-2-yloxyphenyl)prop-2-en-1-ol is sourced from PubChem (CID 118140907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).