2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol

C14H22O2 — CID 117113629

IUPAC2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol
SMILESCOC(C)(C)c1ccccc1C(C)(C)CO
InChIInChI=1S/C14H22O2/c1-13(2,10-15)11-8-6-7-9-12(11)14(3,4)16-5/h6-9,15H,10H2,1-5H3
InChIKeyAYULFSXEYIVRSD-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.84
Rot. Bonds4

About 2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol

2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol (PubChem CID 117113629) has the molecular formula C14H22O2 and a molecular weight of 222.33 g/mol. Its IUPAC name is 2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol
PubChem CID117113629
Molecular FormulaC14H22O2
Molecular Weight222.33 g/mol
Exact Mass222.16
IUPAC Name2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol
SMILESCOC(C)(C)c1ccccc1C(C)(C)CO
InChIInChI=1S/C14H22O2/c1-13(2,10-15)11-8-6-7-9-12(11)14(3,4)16-5/h6-9,15H,10H2,1-5H3
InChIKeyAYULFSXEYIVRSD-UHFFFAOYSA-N
XLogP2.84
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(2-methoxypropan-2-yl)phenyl]acetic acid
CID 117111517
2-[2,3-bis(1-hydroxy-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-ol
CID 67918759
N-[[2-(2-methoxypropan-2-yl)phenyl]methyl]hydroxylamine
CID 117110998
1-[2-(2-methoxypropan-2-yl)phenyl]propan-2-one
CID 117114917
1-methoxy-2-(2-methoxypropan-2-yl)benzene
CID 58091763
2-(1-hydroxy-2-methoxypropan-2-yl)phenol
CID 105440004
1-[2-(2-methoxypropan-2-yl)phenyl]propan-2-ol
CID 117114443
2-(3-chloro-2-methylphenyl)-2-methylpropan-1-ol
CID 117288137
2-(2-methoxypropan-2-yl)benzoic acid
CID 117111487
2-[2-[1-(methoxymethyl)cyclopropyl]phenyl]-2-methylpropan-1-ol
CID 117113680
2-[2-[1-[2-(1-hydroxy-2-methylpropan-2-yl)phenyl]propyl]phenyl]-2-methylpropan-1-ol
CID 70404837
1-(2-methoxypropan-2-yl)-2-[4-(2-methoxypropan-2-yl)phenyl]benzene
CID 139782660

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol?
The IUPAC name of 2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol (CID 117113629) is 2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol.
What is the SMILES notation for 2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol?
The canonical SMILES for 2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol is COC(C)(C)c1ccccc1C(C)(C)CO.
What is the InChIKey of 2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol?
The InChIKey is AYULFSXEYIVRSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O2/c1-13(2,10-15)11-8-6-7-9-12(11)14(3,4)16-5/h6-9,15H,10H2,1-5H3.
What are the key properties of 2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol?
2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol has a molecular weight of 222.33 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxypropan-2-yl)phenyl]-2-methylpropan-1-ol is sourced from PubChem (CID 117113629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).