(1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene

C14H10Cl2F2 — CID 15026496

IUPAC(1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene
SMILESFC(Cl)(c1ccccc1)C(F)(Cl)c1ccccc1
InChIInChI=1S/C14H10Cl2F2/c15-13(17,11-7-3-1-4-8-11)14(16,18)12-9-5-2-6-10-12/h1-10H
InChIKeyGSFDFTICJKBDRT-UHFFFAOYSA-N
MW287.14 g/mol
LogP5.11
Rot. Bonds3

About (1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene

(1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene (PubChem CID 15026496) has the molecular formula C14H10Cl2F2 and a molecular weight of 287.14 g/mol. Its IUPAC name is (1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene.

Molecular Properties

Compound Name(1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene
PubChem CID15026496
Molecular FormulaC14H10Cl2F2
Molecular Weight287.14 g/mol
Exact Mass286.01
IUPAC Name(1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene
SMILESFC(Cl)(c1ccccc1)C(F)(Cl)c1ccccc1
InChIInChI=1S/C14H10Cl2F2/c15-13(17,11-7-3-1-4-8-11)14(16,18)12-9-5-2-6-10-12/h1-10H
InChIKeyGSFDFTICJKBDRT-UHFFFAOYSA-N
XLogP5.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.14
LogP ≤ 55.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

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ethane;bis(trifluoromethylbenzene)
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[chloro(diphenyl)methyl]benzene;dichloromethane
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CID 18759354
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CID 12702818
1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-olate
CID 3796459
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Frequently Asked Questions

What is the IUPAC name of (1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene?
The IUPAC name of (1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene (CID 15026496) is (1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene.
What is the SMILES notation for (1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene?
The canonical SMILES for (1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene is FC(Cl)(c1ccccc1)C(F)(Cl)c1ccccc1.
What is the InChIKey of (1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene?
The InChIKey is GSFDFTICJKBDRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2F2/c15-13(17,11-7-3-1-4-8-11)14(16,18)12-9-5-2-6-10-12/h1-10H.
What are the key properties of (1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene?
(1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene has a molecular weight of 287.14 g/mol, XLogP of 5.11, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2-dichloro-1,2-difluoro-2-phenylethyl)benzene is sourced from PubChem (CID 15026496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).