(2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol

C9H16O3 — CID 130124569

IUPAC(2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol
SMILESCCOC1(CO)CCC=C(C)O1
InChIInChI=1S/C9H16O3/c1-3-11-9(7-10)6-4-5-8(2)12-9/h5,10H,3-4,6-7H2,1-2H3
InChIKeyKOUKRFPYJFZQTG-UHFFFAOYSA-N
MW172.22 g/mol
LogP1.43
Rot. Bonds3

About (2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol

(2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol (PubChem CID 130124569) has the molecular formula C9H16O3 and a molecular weight of 172.22 g/mol. Its IUPAC name is (2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol.

Molecular Properties

Compound Name(2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol
PubChem CID130124569
Molecular FormulaC9H16O3
Molecular Weight172.22 g/mol
Exact Mass172.11
IUPAC Name(2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol
SMILESCCOC1(CO)CCC=C(C)O1
InChIInChI=1S/C9H16O3/c1-3-11-9(7-10)6-4-5-8(2)12-9/h5,10H,3-4,6-7H2,1-2H3
InChIKeyKOUKRFPYJFZQTG-UHFFFAOYSA-N
XLogP1.43
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.22
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2,5-diethoxyoxolan-2-yl)methanol
CID 150634003
ethyl 2-[2-ethoxy-5,5-bis(4-methylphenyl)oxolan-2-yl]acetate
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ethyl 2-oxo-1,8-dioxaspiro[4.5]dec-3-ene-3-carboxylate
CID 66762200
(2-phenylmethoxy-3,4-dihydrochromen-2-yl)methanol
CID 18005860
(2R,3S,4R,5R)-2-ethoxy-2-(hydroxymethyl)oxane-3,4,5-triol
CID 6325163
2-ethoxy-2-ethyloxirane
CID 87059736
(2,6,6-trimethyl-1-propylcyclohex-2-en-1-yl)methanol
CID 57314612
3,4-dihydro-2H-pyran-6-yl-(1-ethoxycyclopentyl)methanone
CID 102647051
7-methyl-2-phenyl-1,3,6-trioxaspiro[4.5]dec-7-ene
CID 86173481
2,2-diethoxy-5,6-dihydro-4H-1-benzofuran
CID 12847451
4-ethoxyoxane-4-carboxylic acid
CID 78969464
cyclohepten-1-yl-(4-ethoxyoxan-4-yl)methanone
CID 106652265

Frequently Asked Questions

What is the IUPAC name of (2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol?
The IUPAC name of (2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol (CID 130124569) is (2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol.
What is the SMILES notation for (2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol?
The canonical SMILES for (2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol is CCOC1(CO)CCC=C(C)O1.
What is the InChIKey of (2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol?
The InChIKey is KOUKRFPYJFZQTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O3/c1-3-11-9(7-10)6-4-5-8(2)12-9/h5,10H,3-4,6-7H2,1-2H3.
What are the key properties of (2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol?
(2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol has a molecular weight of 172.22 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxy-6-methyl-3,4-dihydropyran-2-yl)methanol is sourced from PubChem (CID 130124569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).