(4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene

C20H28O3 — CID 143376124

IUPAC(4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene
SMILESCCCc1ccc(COC)cc1.CCOc1ccc(CO)cc1
InChIInChI=1S/C11H16O.C9H12O2/c1-3-4-10-5-7-11(8-6-10)9-12-2;1-2-11-9-5-3-8(7-10)4-6-9/h5-8H,3-4,9H2,1-2H3;3-6,10H,2,7H2,1H3
InChIKeyPMDMDUWXSHEWIQ-UHFFFAOYSA-N
MW316.44 g/mol
LogP4.36
Rot. Bonds7

About (4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene

(4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene (PubChem CID 143376124) has the molecular formula C20H28O3 and a molecular weight of 316.44 g/mol. Its IUPAC name is (4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene.

Molecular Properties

Compound Name(4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene
PubChem CID143376124
Molecular FormulaC20H28O3
Molecular Weight316.44 g/mol
Exact Mass316.20
IUPAC Name(4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene
SMILESCCCc1ccc(COC)cc1.CCOc1ccc(CO)cc1
InChIInChI=1S/C11H16O.C9H12O2/c1-3-4-10-5-7-11(8-6-10)9-12-2;1-2-11-9-5-3-8(7-10)4-6-9/h5-8H,3-4,9H2,1-2H3;3-6,10H,2,7H2,1H3
InChIKeyPMDMDUWXSHEWIQ-UHFFFAOYSA-N
XLogP4.36
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(methoxymethoxy)phenyl]methanol
CID 11607984
1-ethoxy-4-[(4-ethoxyphenyl)methoxymethyl]benzene
CID 123874930
1-(methoxymethoxy)-4-(methoxymethyl)benzene
CID 59017141
1-(4-ethoxyphenyl)hexan-3-one
CID 64505470
methyl 2-(4-propylphenoxy)acetate
CID 19911850
4-[(4-propylphenoxy)methyl]benzoate
CID 2336592
ethane;1-methoxy-4-propylbenzene
CID 142085762
(4-methoxyphenyl)methanol
CID 7738
2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol
CID 103844538
[3-(4-ethoxyphenyl)-4-methoxyphenyl]methanol
CID 94272407
1-nonoxy-4-propylbenzene
CID 118632119
2-[4-(methoxymethoxy)phenyl]ethanol
CID 16638841

Frequently Asked Questions

What is the IUPAC name of (4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene?
The IUPAC name of (4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene (CID 143376124) is (4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene.
What is the SMILES notation for (4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene?
The canonical SMILES for (4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene is CCCc1ccc(COC)cc1.CCOc1ccc(CO)cc1.
What is the InChIKey of (4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene?
The InChIKey is PMDMDUWXSHEWIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O.C9H12O2/c1-3-4-10-5-7-11(8-6-10)9-12-2;1-2-11-9-5-3-8(7-10)4-6-9/h5-8H,3-4,9H2,1-2H3;3-6,10H,2,7H2,1H3.
What are the key properties of (4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene?
(4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene has a molecular weight of 316.44 g/mol, XLogP of 4.36, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxyphenyl)methanol;1-(methoxymethyl)-4-propylbenzene is sourced from PubChem (CID 143376124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).