1,3-bis(4-fluorophenyl)-2-methylbenzene

C19H14F2 — CID 58586629

IUPAC1,3-bis(4-fluorophenyl)-2-methylbenzene
SMILESCc1c(-c2ccc(F)cc2)cccc1-c1ccc(F)cc1
InChIInChI=1S/C19H14F2/c1-13-18(14-5-9-16(20)10-6-14)3-2-4-19(13)15-7-11-17(21)12-8-15/h2-12H,1H3
InChIKeyVXTNBNRNILNTBC-UHFFFAOYSA-N
MW280.32 g/mol
LogP5.61
Rot. Bonds2

About 1,3-bis(4-fluorophenyl)-2-methylbenzene

1,3-bis(4-fluorophenyl)-2-methylbenzene (PubChem CID 58586629) has the molecular formula C19H14F2 and a molecular weight of 280.32 g/mol. Its IUPAC name is 1,3-bis(4-fluorophenyl)-2-methylbenzene.

Molecular Properties

Compound Name1,3-bis(4-fluorophenyl)-2-methylbenzene
PubChem CID58586629
Molecular FormulaC19H14F2
Molecular Weight280.32 g/mol
Exact Mass280.11
IUPAC Name1,3-bis(4-fluorophenyl)-2-methylbenzene
SMILESCc1c(-c2ccc(F)cc2)cccc1-c1ccc(F)cc1
InChIInChI=1S/C19H14F2/c1-13-18(14-5-9-16(20)10-6-14)3-2-4-19(13)15-7-11-17(21)12-8-15/h2-12H,1H3
InChIKeyVXTNBNRNILNTBC-UHFFFAOYSA-N
XLogP5.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.32
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-fluoro-3-(4-fluorophenyl)-2-methylbenzene
CID 46313945
[3-(4-fluorophenyl)-2-methylphenyl]methanamine
CID 171364549
2-methyl-1-[2-methyl-3-(4-methylphenyl)phenyl]-3-(4-methylphenyl)benzene
CID 157107498
1-(4-fluorophenyl)-8-methylnaphthalene
CID 57338261
6-[3-(4-fluorophenyl)-2-methylphenyl]-5-methylquinazoline-2,4-diamine
CID 134113376
1-fluoro-2-(4-fluorophenyl)-3-phenylbenzene
CID 57054132
1,2-dichloro-3-(4-fluorophenyl)benzene
CID 57058690
5-(4-fluorophenyl)naphthalen-1-amine
CID 172677714
2-(4-fluorophenyl)-6-methylbenzenesulfonic acid
CID 154370865
1-[2-fluoro-6-(4-fluorophenyl)phenyl]ethanone
CID 175686731
1-(4-fluorophenyl)-2,4-dimethyl-3-propan-2-ylbenzene
CID 54376936
1-fluoro-4-[3-(4-methylphenyl)phenyl]benzene
CID 23629230

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(4-fluorophenyl)-2-methylbenzene?
The IUPAC name of 1,3-bis(4-fluorophenyl)-2-methylbenzene (CID 58586629) is 1,3-bis(4-fluorophenyl)-2-methylbenzene.
What is the SMILES notation for 1,3-bis(4-fluorophenyl)-2-methylbenzene?
The canonical SMILES for 1,3-bis(4-fluorophenyl)-2-methylbenzene is Cc1c(-c2ccc(F)cc2)cccc1-c1ccc(F)cc1.
What is the InChIKey of 1,3-bis(4-fluorophenyl)-2-methylbenzene?
The InChIKey is VXTNBNRNILNTBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F2/c1-13-18(14-5-9-16(20)10-6-14)3-2-4-19(13)15-7-11-17(21)12-8-15/h2-12H,1H3.
What are the key properties of 1,3-bis(4-fluorophenyl)-2-methylbenzene?
1,3-bis(4-fluorophenyl)-2-methylbenzene has a molecular weight of 280.32 g/mol, XLogP of 5.61, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(4-fluorophenyl)-2-methylbenzene is sourced from PubChem (CID 58586629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).