2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol

C9H18O2 — CID 90772161

IUPAC2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol
SMILESCC1CCOC1C(C)(C)CO
InChIInChI=1S/C9H18O2/c1-7-4-5-11-8(7)9(2,3)6-10/h7-8,10H,4-6H2,1-3H3
InChIKeyYCYTYCVYXGGCQY-UHFFFAOYSA-N
MW158.24 g/mol
LogP1.43
Rot. Bonds2

About 2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol

2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol (PubChem CID 90772161) has the molecular formula C9H18O2 and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol.

Molecular Properties

Compound Name2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol
PubChem CID90772161
Molecular FormulaC9H18O2
Molecular Weight158.24 g/mol
Exact Mass158.13
IUPAC Name2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol
SMILESCC1CCOC1C(C)(C)CO
InChIInChI=1S/C9H18O2/c1-7-4-5-11-8(7)9(2,3)6-10/h7-8,10H,4-6H2,1-3H3
InChIKeyYCYTYCVYXGGCQY-UHFFFAOYSA-N
XLogP1.43
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2R,3R)-3-methyloxolan-2-yl]ethanol
CID 134950887
2-tert-butyl-3-methyloxepane
CID 121477234
(2R,3S)-2-(bromomethyl)-3-methyloxolane
CID 155905802
(2-tert-butyloxan-3-yl)methanol
CID 79373679
2-methyl-2-(3-methylcyclopentyl)propan-1-ol
CID 130126553
2-(1,3-dioxolan-4-yl)-2-methylpropan-1-ol
CID 56996768
5-(1-hydroxy-2-methylpropan-2-yl)oxolane-2,3,4-triol
CID 166752662
2,3-ditert-butyloxolane
CID 58782145
methanol;(2S,3R)-2,3,4-trimethyloxane
CID 145399685
2-cycloheptyl-2-methylpropan-1-ol
CID 82936558
2-ethyl-2-(hydroxymethyl)propane-1,3-diol;2-methyloxirane;oxirane
CID 6451422
tert-butyl-dimethyl-[[(2R,3R)-3-methyloxolan-2-yl]methoxy]silane
CID 102031042

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol?
The IUPAC name of 2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol (CID 90772161) is 2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol.
What is the SMILES notation for 2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol?
The canonical SMILES for 2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol is CC1CCOC1C(C)(C)CO.
What is the InChIKey of 2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol?
The InChIKey is YCYTYCVYXGGCQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O2/c1-7-4-5-11-8(7)9(2,3)6-10/h7-8,10H,4-6H2,1-3H3.
What are the key properties of 2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol?
2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol has a molecular weight of 158.24 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(3-methyloxolan-2-yl)propan-1-ol is sourced from PubChem (CID 90772161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).