1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene

C19H24O5 — CID 142654799

IUPAC1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene
SMILESCOc1ccc(Cc2c(C)c(OC)c(OC)c(OC)c2OC)cc1
InChIInChI=1S/C19H24O5/c1-12-15(11-13-7-9-14(20-2)10-8-13)17(22-4)19(24-6)18(23-5)16(12)21-3/h7-10H,11H2,1-6H3
InChIKeyLPUNIZWASLYSPX-UHFFFAOYSA-N
MW332.40 g/mol
LogP3.63
Rot. Bonds7

About 1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene

1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene (PubChem CID 142654799) has the molecular formula C19H24O5 and a molecular weight of 332.40 g/mol. Its IUPAC name is 1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene.

Molecular Properties

Compound Name1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene
PubChem CID142654799
Molecular FormulaC19H24O5
Molecular Weight332.40 g/mol
Exact Mass332.16
IUPAC Name1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene
SMILESCOc1ccc(Cc2c(C)c(OC)c(OC)c(OC)c2OC)cc1
InChIInChI=1S/C19H24O5/c1-12-15(11-13-7-9-14(20-2)10-8-13)17(22-4)19(24-6)18(23-5)16(12)21-3/h7-10H,11H2,1-6H3
InChIKeyLPUNIZWASLYSPX-UHFFFAOYSA-N
XLogP3.63
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene?
The IUPAC name of 1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene (CID 142654799) is 1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene.
What is the SMILES notation for 1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene?
The canonical SMILES for 1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene is COc1ccc(Cc2c(C)c(OC)c(OC)c(OC)c2OC)cc1.
What is the InChIKey of 1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene?
The InChIKey is LPUNIZWASLYSPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O5/c1-12-15(11-13-7-9-14(20-2)10-8-13)17(22-4)19(24-6)18(23-5)16(12)21-3/h7-10H,11H2,1-6H3.
What are the key properties of 1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene?
1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene has a molecular weight of 332.40 g/mol, XLogP of 3.63, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene is sourced from PubChem (CID 142654799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).