2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone

C20H24O5 — CID 14762562

IUPAC2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone
SMILESCOCCOC(OCCOC)(C(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H24O5/c1-22-13-15-24-20(25-16-14-23-2,18-11-7-4-8-12-18)19(21)17-9-5-3-6-10-17/h3-12H,13-16H2,1-2H3
InChIKeyREDHFWWXDPLRKB-UHFFFAOYSA-N
MW344.41 g/mol
LogP3.05
Rot. Bonds11

About 2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone

2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone (PubChem CID 14762562) has the molecular formula C20H24O5 and a molecular weight of 344.41 g/mol. Its IUPAC name is 2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone.

Molecular Properties

Compound Name2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone
PubChem CID14762562
Molecular FormulaC20H24O5
Molecular Weight344.41 g/mol
Exact Mass344.16
IUPAC Name2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone
SMILESCOCCOC(OCCOC)(C(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H24O5/c1-22-13-15-24-20(25-16-14-23-2,18-11-7-4-8-12-18)19(21)17-9-5-3-6-10-17/h3-12H,13-16H2,1-2H3
InChIKeyREDHFWWXDPLRKB-UHFFFAOYSA-N
XLogP3.05
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2,2-bis(2-dimethoxyphosphorylethoxy)-1,2-diphenylethanone
CID 21312878
2,2-dimethoxy-1,2-diphenylethanone;molecular iodine
CID 161260552
2,2-bis[2-(1,3-dihydroxy-4,5,6,7-tetrahydroisoindol-2-yl)ethoxy]-1,2-diphenylethanone
CID 54008657
1-[4-[4-(2,2-dimethoxy-2-phenylacetyl)benzoyl]phenyl]-2,2-dimethoxy-2-phenylethanone
CID 174419072
2,2-di(butan-2-yloxy)-1,2-diphenylethanone
CID 19035365
2-methoxy-2-methylperoxy-1,2-diphenylethanone;prop-2-enoic acid
CID 88598506
2-(aminomethoxy)-2-methoxy-1-(4-methoxyphenyl)-2-phenylethanone
CID 139805914
1-(3-tert-butylphenyl)-2,2-dimethoxy-2-phenylethanone
CID 15697899
2-chloro-1,2,2-triphenylethanone
CID 11301235
2,2-bis(2-hydroxy-3-prop-2-enoxypropoxy)-1,2-diphenylethanone
CID 15156922
3-methoxy-1-phenylpropan-1-one
CID 10942788
4-[4-(1,1-dimethoxy-2-oxo-2-phenylethyl)phenyl]sulfanylbutane-1-sulfonic acid
CID 59816690

Frequently Asked Questions

What is the IUPAC name of 2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone?
The IUPAC name of 2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone (CID 14762562) is 2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone.
What is the SMILES notation for 2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone?
The canonical SMILES for 2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone is COCCOC(OCCOC)(C(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone?
The InChIKey is REDHFWWXDPLRKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24O5/c1-22-13-15-24-20(25-16-14-23-2,18-11-7-4-8-12-18)19(21)17-9-5-3-6-10-17/h3-12H,13-16H2,1-2H3.
What are the key properties of 2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone?
2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone has a molecular weight of 344.41 g/mol, XLogP of 3.05, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone is sourced from PubChem (CID 14762562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).