(3,4-dimethoxyphenyl)methoxymethanol

C10H14O4 — CID 69007274

IUPAC(3,4-dimethoxyphenyl)methoxymethanol
SMILESCOc1ccc(COCO)cc1OC
InChIInChI=1S/C10H14O4/c1-12-9-4-3-8(6-14-7-11)5-10(9)13-2/h3-5,11H,6-7H2,1-2H3
InChIKeyVZEWXFOSYBAPPA-UHFFFAOYSA-N
MW198.22 g/mol
LogP1.17
Rot. Bonds5

About (3,4-dimethoxyphenyl)methoxymethanol

(3,4-dimethoxyphenyl)methoxymethanol (PubChem CID 69007274) has the molecular formula C10H14O4 and a molecular weight of 198.22 g/mol. Its IUPAC name is (3,4-dimethoxyphenyl)methoxymethanol.

Molecular Properties

Compound Name(3,4-dimethoxyphenyl)methoxymethanol
PubChem CID69007274
Molecular FormulaC10H14O4
Molecular Weight198.22 g/mol
Exact Mass198.09
IUPAC Name(3,4-dimethoxyphenyl)methoxymethanol
SMILESCOc1ccc(COCO)cc1OC
InChIInChI=1S/C10H14O4/c1-12-9-4-3-8(6-14-7-11)5-10(9)13-2/h3-5,11H,6-7H2,1-2H3
InChIKeyVZEWXFOSYBAPPA-UHFFFAOYSA-N
XLogP1.17
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-[(3,4-dimethoxyphenyl)methoxy]acetic acid
CID 10727925
(3,4,5-trimethoxyphenyl)methoxymethanol
CID 167081635
(3R)-5-[(3,4-dimethoxyphenyl)methoxy]-3-methylpentane-1,3-diol
CID 16736187
4-[(4-hydroxy-3-methoxyphenyl)methoxymethyl]-2-methoxyphenol
CID 22599015
1-[(3,4-dimethoxyphenyl)methoxy]-3-tri(propan-2-yl)silyloxypropan-2-ol
CID 67253770
4-(ethenoxymethyl)-1,2-dimethoxybenzene
CID 86205120
(3,4-dimethoxyphenyl)methyl nitrate;methoxymethane
CID 174862254
2-[2-methoxy-4-(methoxymethyl)phenoxy]ethanol
CID 102411892
[(2S)-3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxypropyl]-ethylazanium
CID 2104429
1-[(3,4-dimethoxyphenyl)methoxymethyl]cyclopentan-1-amine
CID 64572667
1,2-dimethoxy-4-(methoxymethyl)benzene;sulfuryl dichloride
CID 87637876
dimethyl (2R,3R)-2,3-bis[(3,4-dimethoxyphenyl)methoxy]butanedioate
CID 171933870

Frequently Asked Questions

What is the IUPAC name of (3,4-dimethoxyphenyl)methoxymethanol?
The IUPAC name of (3,4-dimethoxyphenyl)methoxymethanol (CID 69007274) is (3,4-dimethoxyphenyl)methoxymethanol.
What is the SMILES notation for (3,4-dimethoxyphenyl)methoxymethanol?
The canonical SMILES for (3,4-dimethoxyphenyl)methoxymethanol is COc1ccc(COCO)cc1OC.
What is the InChIKey of (3,4-dimethoxyphenyl)methoxymethanol?
The InChIKey is VZEWXFOSYBAPPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O4/c1-12-9-4-3-8(6-14-7-11)5-10(9)13-2/h3-5,11H,6-7H2,1-2H3.
What are the key properties of (3,4-dimethoxyphenyl)methoxymethanol?
(3,4-dimethoxyphenyl)methoxymethanol has a molecular weight of 198.22 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethoxyphenyl)methoxymethanol is sourced from PubChem (CID 69007274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).