1,3-bis(4-methoxyphenoxy)benzene

C20H18O4 — CID 629519

IUPAC1,3-bis(4-methoxyphenoxy)benzene
SMILESCOc1ccc(Oc2cccc(Oc3ccc(OC)cc3)c2)cc1
InChIInChI=1S/C20H18O4/c1-21-15-6-10-17(11-7-15)23-19-4-3-5-20(14-19)24-18-12-8-16(22-2)9-13-18/h3-14H,1-2H3
InChIKeyMUFYVNCRQIHDCE-UHFFFAOYSA-N
MW322.36 g/mol
LogP5.29
Rot. Bonds6

About 1,3-bis(4-methoxyphenoxy)benzene

1,3-bis(4-methoxyphenoxy)benzene (PubChem CID 629519) has the molecular formula C20H18O4 and a molecular weight of 322.36 g/mol. Its IUPAC name is 1,3-bis(4-methoxyphenoxy)benzene.

Molecular Properties

Compound Name1,3-bis(4-methoxyphenoxy)benzene
PubChem CID629519
Molecular FormulaC20H18O4
Molecular Weight322.36 g/mol
Exact Mass322.12
IUPAC Name1,3-bis(4-methoxyphenoxy)benzene
SMILESCOc1ccc(Oc2cccc(Oc3ccc(OC)cc3)c2)cc1
InChIInChI=1S/C20H18O4/c1-21-15-6-10-17(11-7-15)23-19-4-3-5-20(14-19)24-18-12-8-16(22-2)9-13-18/h3-14H,1-2H3
InChIKeyMUFYVNCRQIHDCE-UHFFFAOYSA-N
XLogP5.29
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.36
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-methoxy-3-[4-[4-(3-methoxyphenoxy)phenoxy]phenoxy]benzene
CID 139804491
1,3-dimethoxybenzene;1,4-dimethoxybenzene
CID 91359455
4-(3-methoxyphenoxy)benzonitrile
CID 15643687
1-[4-(3-methoxyphenoxy)phenyl]ethanol
CID 43506404
1-[3-(4-methoxyphenoxy)phenyl]ethanamine
CID 79016052
1-methoxy-3-[2-[3-[4-[2-(4-methoxyphenyl)ethyl]phenoxy]phenyl]ethyl]benzene
CID 172870937
tris(1,3-dimethoxybenzene);phosphane
CID 160853878
azane;1,3-dimethoxybenzene
CID 70210283
CID 172849383
CID 172849383
4-(3-methoxyphenoxy)benzenesulfonyl chloride
CID 18071781
2-[4-(3-methoxyphenoxy)phenyl]furan
CID 168524914
(NZ)-N-[[3-(4-methoxyphenoxy)phenyl]methylidene]hydroxylamine
CID 59496691

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(4-methoxyphenoxy)benzene?
The IUPAC name of 1,3-bis(4-methoxyphenoxy)benzene (CID 629519) is 1,3-bis(4-methoxyphenoxy)benzene.
What is the SMILES notation for 1,3-bis(4-methoxyphenoxy)benzene?
The canonical SMILES for 1,3-bis(4-methoxyphenoxy)benzene is COc1ccc(Oc2cccc(Oc3ccc(OC)cc3)c2)cc1.
What is the InChIKey of 1,3-bis(4-methoxyphenoxy)benzene?
The InChIKey is MUFYVNCRQIHDCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18O4/c1-21-15-6-10-17(11-7-15)23-19-4-3-5-20(14-19)24-18-12-8-16(22-2)9-13-18/h3-14H,1-2H3.
What are the key properties of 1,3-bis(4-methoxyphenoxy)benzene?
1,3-bis(4-methoxyphenoxy)benzene has a molecular weight of 322.36 g/mol, XLogP of 5.29, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(4-methoxyphenoxy)benzene is sourced from PubChem (CID 629519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).