methanol;4-oxaspiro[2.4]heptane

C7H14O2 — CID 144744375

IUPACmethanol;4-oxaspiro[2.4]heptane
SMILESC1COC2(C1)CC2.CO
InChIInChI=1S/C6H10O.CH4O/c1-2-6(3-4-6)7-5-1;1-2/h1-5H2;2H,1H3
InChIKeyATRKEWXPNPWWHX-UHFFFAOYSA-N
MW130.19 g/mol
LogP0.94
Rot. Bonds

About methanol;4-oxaspiro[2.4]heptane

methanol;4-oxaspiro[2.4]heptane (PubChem CID 144744375) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is methanol;4-oxaspiro[2.4]heptane.

Molecular Properties

Compound Namemethanol;4-oxaspiro[2.4]heptane
PubChem CID144744375
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Namemethanol;4-oxaspiro[2.4]heptane
SMILESC1COC2(C1)CC2.CO
InChIInChI=1S/C6H10O.CH4O/c1-2-6(3-4-6)7-5-1;1-2/h1-5H2;2H,1H3
InChIKeyATRKEWXPNPWWHX-UHFFFAOYSA-N
XLogP0.94
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5R,7S)-4,8-dioxadispiro[4.1.47.35]tetradecane
CID 101092010
methanamine;molecular hydrogen;1-oxaspiro[3.5]nonane
CID 171551994
N,N-dimethyl-1-oxaspiro[4.5]decan-8-amine
CID 58035405
ethane;9-methyl-1-oxaspiro[5.5]undecane
CID 145047739
8-ethyl-1-oxaspiro[4.5]decane
CID 137449478
1-oxaspiro[4.5]decan-8-amine
CID 67070405
(5R,6R,12R)-4,7,13-trioxatrispiro[4.0.46.1.412.25]octadecane
CID 101092012
8-propyl-1-oxa-8-azaspiro[4.5]decane
CID 149367248
1-oxaspiro[4.5]decane-8-carbonitrile
CID 67072839
(5S)-9-methyl-1-oxa-9-azaspiro[4.5]decane
CID 167468674
ethane;9-propan-2-yl-1-oxa-9-azaspiro[4.6]undecane
CID 158051450
5-oxaspiro[3.4]octane-2-carboxylic acid
CID 56962178

Frequently Asked Questions

What is the IUPAC name of methanol;4-oxaspiro[2.4]heptane?
The IUPAC name of methanol;4-oxaspiro[2.4]heptane (CID 144744375) is methanol;4-oxaspiro[2.4]heptane.
What is the SMILES notation for methanol;4-oxaspiro[2.4]heptane?
The canonical SMILES for methanol;4-oxaspiro[2.4]heptane is C1COC2(C1)CC2.CO.
What is the InChIKey of methanol;4-oxaspiro[2.4]heptane?
The InChIKey is ATRKEWXPNPWWHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O.CH4O/c1-2-6(3-4-6)7-5-1;1-2/h1-5H2;2H,1H3.
What are the key properties of methanol;4-oxaspiro[2.4]heptane?
methanol;4-oxaspiro[2.4]heptane has a molecular weight of 130.19 g/mol, XLogP of 0.94, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;4-oxaspiro[2.4]heptane is sourced from PubChem (CID 144744375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).