formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene)

C31H34O3 — CID 175275695

IUPACformaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene)
SMILESC=O.COc1ccc(-c2cccc(C)c2)cc1C.COc1ccc(-c2cccc(C)c2)cc1C
InChIInChI=1S/2C15H16O.CH2O/c2*1-11-5-4-6-13(9-11)14-7-8-15(16-3)12(2)10-14;1-2/h2*4-10H,1-3H3;1H2
InChIKeyVUJSNWPJLBJMNX-UHFFFAOYSA-N
MW454.61 g/mol
LogP7.77
Rot. Bonds4

About formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene)

formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene) (PubChem CID 175275695) has the molecular formula C31H34O3 and a molecular weight of 454.61 g/mol. Its IUPAC name is formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene).

Molecular Properties

Compound Nameformaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene)
PubChem CID175275695
Molecular FormulaC31H34O3
Molecular Weight454.61 g/mol
Exact Mass454.25
IUPAC Nameformaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene)
SMILESC=O.COc1ccc(-c2cccc(C)c2)cc1C.COc1ccc(-c2cccc(C)c2)cc1C
InChIInChI=1S/2C15H16O.CH2O/c2*1-11-5-4-6-13(9-11)14-7-8-15(16-3)12(2)10-14;1-2/h2*4-10H,1-3H3;1H2
InChIKeyVUJSNWPJLBJMNX-UHFFFAOYSA-N
XLogP7.77
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.61
LogP ≤ 57.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene
CID 161175155
1-bromo-2-methoxy-4-(3-methylphenyl)benzene
CID 164895138
1-methoxy-2,4-dimethyl(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene
CID 169444379
2-[2-methyl-4-(3-methylphenyl)phenoxy]ethanamine
CID 163408322
[3-(4-methoxy-3-methylphenyl)phenyl]-(3-methoxyphenyl)methanone
CID 56970113
1-[3-(4-methoxy-3-methylphenyl)phenyl]-N-methylmethanamine
CID 61034321
4-[3-(3-chloropropoxy)phenyl]-1-methoxy-2-methylbenzene
CID 39396728
[2-methyl-4-(3-methylphenyl)phenyl] 2-iodobenzoate
CID 615921
ethane;1-methoxy-3-(3-methylphenyl)benzene
CID 142945497
1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 58879503
1-methyl-3-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene
CID 58892418
methane;1-methyl-3-(4-methylphenyl)benzene
CID 158328523

Frequently Asked Questions

What is the IUPAC name of formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene)?
The IUPAC name of formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene) (CID 175275695) is formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene).
What is the SMILES notation for formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene)?
The canonical SMILES for formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene) is C=O.COc1ccc(-c2cccc(C)c2)cc1C.COc1ccc(-c2cccc(C)c2)cc1C.
What is the InChIKey of formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene)?
The InChIKey is VUJSNWPJLBJMNX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H16O.CH2O/c2*1-11-5-4-6-13(9-11)14-7-8-15(16-3)12(2)10-14;1-2/h2*4-10H,1-3H3;1H2.
What are the key properties of formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene)?
formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene) has a molecular weight of 454.61 g/mol, XLogP of 7.77, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;bis(1-methoxy-2-methyl-4-(3-methylphenyl)benzene) is sourced from PubChem (CID 175275695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).