copper;3-(4-propan-2-yloxyphenyl)propan-1-ol

C12H18CuO2 — CID 70633990

IUPACcopper;3-(4-propan-2-yloxyphenyl)propan-1-ol
SMILESCC(C)Oc1ccc(CCCO)cc1.[Cu]
InChIInChI=1S/C12H18O2.Cu/c1-10(2)14-12-7-5-11(6-8-12)4-3-9-13;/h5-8,10,13H,3-4,9H2,1-2H3;
InChIKeyQBJXJGQFOLFTAH-UHFFFAOYSA-N
MW257.82 g/mol
LogP2.40
Rot. Bonds5

About copper;3-(4-propan-2-yloxyphenyl)propan-1-ol

copper;3-(4-propan-2-yloxyphenyl)propan-1-ol (PubChem CID 70633990) has the molecular formula C12H18CuO2 and a molecular weight of 257.82 g/mol. Its IUPAC name is copper;3-(4-propan-2-yloxyphenyl)propan-1-ol.

Molecular Properties

Compound Namecopper;3-(4-propan-2-yloxyphenyl)propan-1-ol
PubChem CID70633990
Molecular FormulaC12H18CuO2
Molecular Weight257.82 g/mol
Exact Mass257.06
IUPAC Namecopper;3-(4-propan-2-yloxyphenyl)propan-1-ol
SMILESCC(C)Oc1ccc(CCCO)cc1.[Cu]
InChIInChI=1S/C12H18O2.Cu/c1-10(2)14-12-7-5-11(6-8-12)4-3-9-13;/h5-8,10,13H,3-4,9H2,1-2H3;
InChIKeyQBJXJGQFOLFTAH-UHFFFAOYSA-N
XLogP2.40
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.82
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(4-propan-2-yloxyphenyl)pentan-1-amine
CID 54244328
3-methyl-2-[2-(4-propan-2-yloxyphenyl)ethylamino]butan-1-ol
CID 115137707
4-(4-propan-2-yloxyphenyl)butan-2-one
CID 24710648
N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine
CID 170569416
2-[4-(difluoromethoxy)phenyl]ethanol;ethane
CID 142357995
3-(4-propan-2-yloxyphenyl)propanethioamide
CID 83932816
N-ethyl-5-(4-propan-2-yloxyphenyl)pentan-1-amine
CID 65300939
4-hydroxy-5-[4-(4-propan-2-yloxyphenyl)butyl]-3H-1,3-thiazol-2-one
CID 54214158
2-[4-(4-propan-2-yloxyphenyl)phenyl]ethanamine
CID 39357518
4-chloro-4-(4-propan-2-yloxyphenyl)butan-1-ol
CID 82366966
4-hydroxy-1-(4-propan-2-yloxyphenyl)butan-1-one
CID 98014339
(4-propan-2-yloxyphenyl)-(4-propylphenyl)methanol
CID 63890920

Frequently Asked Questions

What is the IUPAC name of copper;3-(4-propan-2-yloxyphenyl)propan-1-ol?
The IUPAC name of copper;3-(4-propan-2-yloxyphenyl)propan-1-ol (CID 70633990) is copper;3-(4-propan-2-yloxyphenyl)propan-1-ol.
What is the SMILES notation for copper;3-(4-propan-2-yloxyphenyl)propan-1-ol?
The canonical SMILES for copper;3-(4-propan-2-yloxyphenyl)propan-1-ol is CC(C)Oc1ccc(CCCO)cc1.[Cu].
What is the InChIKey of copper;3-(4-propan-2-yloxyphenyl)propan-1-ol?
The InChIKey is QBJXJGQFOLFTAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2.Cu/c1-10(2)14-12-7-5-11(6-8-12)4-3-9-13;/h5-8,10,13H,3-4,9H2,1-2H3;.
What are the key properties of copper;3-(4-propan-2-yloxyphenyl)propan-1-ol?
copper;3-(4-propan-2-yloxyphenyl)propan-1-ol has a molecular weight of 257.82 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper;3-(4-propan-2-yloxyphenyl)propan-1-ol is sourced from PubChem (CID 70633990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).