1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene

C26H30O2 — CID 174752402

IUPAC1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene
SMILESCC(C)(C)Oc1ccc(-c2ccccc2-c2ccccc2)cc1OC(C)(C)C
InChIInChI=1S/C26H30O2/c1-25(2,3)27-23-17-16-20(18-24(23)28-26(4,5)6)22-15-11-10-14-21(22)19-12-8-7-9-13-19/h7-18H,1-6H3
InChIKeyBLSPHXRFMRNMIE-UHFFFAOYSA-N
MW374.52 g/mol
LogP7.38
Rot. Bonds4

About 1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene

1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene (PubChem CID 174752402) has the molecular formula C26H30O2 and a molecular weight of 374.52 g/mol. Its IUPAC name is 1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene.

Molecular Properties

Compound Name1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene
PubChem CID174752402
Molecular FormulaC26H30O2
Molecular Weight374.52 g/mol
Exact Mass374.22
IUPAC Name1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene
SMILESCC(C)(C)Oc1ccc(-c2ccccc2-c2ccccc2)cc1OC(C)(C)C
InChIInChI=1S/C26H30O2/c1-25(2,3)27-23-17-16-20(18-24(23)28-26(4,5)6)22-15-11-10-14-21(22)19-12-8-7-9-13-19/h7-18H,1-6H3
InChIKeyBLSPHXRFMRNMIE-UHFFFAOYSA-N
XLogP7.38
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.52
LogP ≤ 57.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-[3,4-bis[(2-methylpropan-2-yl)oxy]phenyl]phenyl]-1,2-bis[(2-methylpropan-2-yl)oxy]benzene
CID 150309669
1,2-bis(4-chlorophenyl)-3-[(2-methylpropan-2-yl)oxy]benzene
CID 173271826
3-[(2-methylpropan-2-yl)oxy]-1,2,4,5-tetraphenylbenzene
CID 126747094
2-methyl-1-phenyl-4-(2-phenylphenyl)benzene
CID 59171665
tricyclo[6.6.0.02,6]tetradeca-1,3,5,7,9,11,13-heptaene
CID 101119071
CID 69011285
CID 69011285
1-chloro-3-(2-phenylphenyl)benzene
CID 69293962
2-methoxy-7-(2-phenylphenyl)naphthalene
CID 141340555
1-methyl-4-[2-(3-phenylphenyl)phenyl]benzene
CID 58390014
2-(4-phenylphenyl)bicyclo[2.2.0]hexa-1,3,5-triene
CID 174878589
1,2-bis(3-tert-butylphenyl)benzene
CID 164767999
4-(2-methylphenyl)-1,2-diphenylbenzene
CID 59171693

Frequently Asked Questions

What is the IUPAC name of 1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene?
The IUPAC name of 1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene (CID 174752402) is 1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene.
What is the SMILES notation for 1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene?
The canonical SMILES for 1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene is CC(C)(C)Oc1ccc(-c2ccccc2-c2ccccc2)cc1OC(C)(C)C.
What is the InChIKey of 1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene?
The InChIKey is BLSPHXRFMRNMIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30O2/c1-25(2,3)27-23-17-16-20(18-24(23)28-26(4,5)6)22-15-11-10-14-21(22)19-12-8-7-9-13-19/h7-18H,1-6H3.
What are the key properties of 1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene?
1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene has a molecular weight of 374.52 g/mol, XLogP of 7.38, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis[(2-methylpropan-2-yl)oxy]-4-(2-phenylphenyl)benzene is sourced from PubChem (CID 174752402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).