(3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone

C32H32O4 — CID 162090190

IUPAC(3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone
SMILESCOc1ccc(C(=O)c2ccc(C)c(C)c2)cc1C.COc1ccc(C(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C17H18O2.C15H14O2/c1-11-5-6-14(9-12(11)2)17(18)15-7-8-16(19-4)13(3)10-15;1-11-3-5-12(6-4-11)15(16)13-7-9-14(17-2)10-8-13/h5-10H,1-4H3;3-10H,1-2H3
InChIKeyZDMOZTLTQFFQPV-UHFFFAOYSA-N
MW480.60 g/mol
LogP7.09
Rot. Bonds6

About (3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone

(3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone (PubChem CID 162090190) has the molecular formula C32H32O4 and a molecular weight of 480.60 g/mol. Its IUPAC name is (3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone.

Molecular Properties

Compound Name(3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone
PubChem CID162090190
Molecular FormulaC32H32O4
Molecular Weight480.60 g/mol
Exact Mass480.23
IUPAC Name(3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone
SMILESCOc1ccc(C(=O)c2ccc(C)c(C)c2)cc1C.COc1ccc(C(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C17H18O2.C15H14O2/c1-11-5-6-14(9-12(11)2)17(18)15-7-8-16(19-4)13(3)10-15;1-11-3-5-12(6-4-11)15(16)13-7-9-14(17-2)10-8-13/h5-10H,1-4H3;3-10H,1-2H3
InChIKeyZDMOZTLTQFFQPV-UHFFFAOYSA-N
XLogP7.09
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500480.60
LogP ≤ 57.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3,4-dimethylphenyl)-[4-(4-methoxyphenoxy)-3-methylphenyl]methanone
CID 59022177
[4-[4-(4-methoxybenzoyl)benzoyl]phenyl]-(4-methylphenyl)methanone
CID 90306891
(3,4-dimethylphenyl)-(4-methylphenyl)methanone;1,2,4,5-tetramethylbenzene
CID 159278284
methane;(4-methoxyphenyl)-(4-methylphenyl)methanone
CID 161368875
(4-hydroxyphenyl)-(4-methoxy-3-methylphenyl)methanone
CID 70142361
(4-methylphenyl) 4-methoxy-3-methylbenzoate
CID 145312740
[4-[4-[4-[4-[4-[4-[4-(4-methoxyphenoxy)benzoyl]phenoxy]phenoxy]benzoyl]phenoxy]phenoxy]phenyl]-(4-methylphenyl)methanone
CID 20643575
(4-cyclopropyloxyphenyl)-(4-methoxy-3-methylphenyl)methanone
CID 114518942
bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1,2,4,5-tetramethylbenzene
CID 159619159
(4-methoxy-3-methylphenyl)-(4-methylsulfanylphenyl)methanone
CID 79214841
[4-[4-[3-(4-methoxybenzoyl)benzoyl]phenoxy]phenyl]-(4-methylphenyl)methanone;[4-[4-[4-(4-methoxybenzoyl)benzoyl]phenoxy]phenyl]-(4-methylphenyl)methanone;(4-methoxyphenyl)-[3-[4-(4-methylphenoxy)benzoyl]phenyl]methanone;(4-methoxyphenyl)-[4-[4-(4-methylphenoxy)benzoyl]phenyl]methanone
CID 160674185
(4-methoxyphenyl)-[3-[4-(4-methylphenoxy)benzoyl]phenyl]methanone
CID 58399730

Frequently Asked Questions

What is the IUPAC name of (3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone?
The IUPAC name of (3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone (CID 162090190) is (3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone.
What is the SMILES notation for (3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone?
The canonical SMILES for (3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone is COc1ccc(C(=O)c2ccc(C)c(C)c2)cc1C.COc1ccc(C(=O)c2ccc(C)cc2)cc1.
What is the InChIKey of (3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone?
The InChIKey is ZDMOZTLTQFFQPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2.C15H14O2/c1-11-5-6-14(9-12(11)2)17(18)15-7-8-16(19-4)13(3)10-15;1-11-3-5-12(6-4-11)15(16)13-7-9-14(17-2)10-8-13/h5-10H,1-4H3;3-10H,1-2H3.
What are the key properties of (3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone?
(3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone has a molecular weight of 480.60 g/mol, XLogP of 7.09, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethylphenyl)-(4-methoxy-3-methylphenyl)methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone is sourced from PubChem (CID 162090190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).