2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene

C19H15ClO — CID 173255261

IUPAC2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene
SMILESCOc1cccc(-c2ccc(-c3ccccc3)cc2Cl)c1
InChIInChI=1S/C19H15ClO/c1-21-17-9-5-8-16(12-17)18-11-10-15(13-19(18)20)14-6-3-2-4-7-14/h2-13H,1H3
InChIKeyLOJLEZXKKAUALZ-UHFFFAOYSA-N
MW294.78 g/mol
LogP5.68
Rot. Bonds3

About 2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene

2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene (PubChem CID 173255261) has the molecular formula C19H15ClO and a molecular weight of 294.78 g/mol. Its IUPAC name is 2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene.

Molecular Properties

Compound Name2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene
PubChem CID173255261
Molecular FormulaC19H15ClO
Molecular Weight294.78 g/mol
Exact Mass294.08
IUPAC Name2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene
SMILESCOc1cccc(-c2ccc(-c3ccccc3)cc2Cl)c1
InChIInChI=1S/C19H15ClO/c1-21-17-9-5-8-16(12-17)18-11-10-15(13-19(18)20)14-6-3-2-4-7-14/h2-13H,1H3
InChIKeyLOJLEZXKKAUALZ-UHFFFAOYSA-N
XLogP5.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.78
LogP ≤ 55.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-chloro-1-fluoro-4-(3-methoxyphenyl)benzene
CID 91071120
1-methoxy-3-[4-(4-methoxyphenyl)phenyl]benzene
CID 25138852
2-[3-chloro-4-(3-methoxyphenyl)phenyl]acetic acid
CID 176516046
1-methoxy-4-[3-(3-methoxyphenyl)phenyl]benzene
CID 66934064
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
2-(4-methoxyphenyl)-1,4-diphenylbenzene
CID 132547745
4-(3-methoxyphenyl)-N,N-diphenylaniline
CID 175141155
2-methoxy-1-[3-methoxy-4-(3-methoxyphenyl)phenyl]-4-(2-methoxyphenyl)benzene
CID 174295636
1-chloro-4-(chloromethyl)-2-(3-methoxyphenyl)benzene
CID 82122933
1-(4-tert-butylphenyl)-2-chloro-4-phenylbenzene
CID 176866089
2-[2-(3-methoxyphenyl)phenyl]phenol
CID 135057832

Frequently Asked Questions

What is the IUPAC name of 2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene?
The IUPAC name of 2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene (CID 173255261) is 2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene.
What is the SMILES notation for 2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene?
The canonical SMILES for 2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene is COc1cccc(-c2ccc(-c3ccccc3)cc2Cl)c1.
What is the InChIKey of 2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene?
The InChIKey is LOJLEZXKKAUALZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClO/c1-21-17-9-5-8-16(12-17)18-11-10-15(13-19(18)20)14-6-3-2-4-7-14/h2-13H,1H3.
What are the key properties of 2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene?
2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene has a molecular weight of 294.78 g/mol, XLogP of 5.68, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene is sourced from PubChem (CID 173255261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).