1-bromo-4-[1-(2-methylphenyl)ethyl]benzene

C15H15Br — CID 71518832

IUPAC1-bromo-4-[1-(2-methylphenyl)ethyl]benzene
SMILESCc1ccccc1C(C)c1ccc(Br)cc1
InChIInChI=1S/C15H15Br/c1-11-5-3-4-6-15(11)12(2)13-7-9-14(16)10-8-13/h3-10,12H,1-2H3
InChIKeyBFMIGQICNZDCQQ-UHFFFAOYSA-N
MW275.19 g/mol
LogP4.91
Rot. Bonds2

About 1-bromo-4-[1-(2-methylphenyl)ethyl]benzene

1-bromo-4-[1-(2-methylphenyl)ethyl]benzene (PubChem CID 71518832) has the molecular formula C15H15Br and a molecular weight of 275.19 g/mol. Its IUPAC name is 1-bromo-4-[1-(2-methylphenyl)ethyl]benzene.

Molecular Properties

Compound Name1-bromo-4-[1-(2-methylphenyl)ethyl]benzene
PubChem CID71518832
Molecular FormulaC15H15Br
Molecular Weight275.19 g/mol
Exact Mass274.04
IUPAC Name1-bromo-4-[1-(2-methylphenyl)ethyl]benzene
SMILESCc1ccccc1C(C)c1ccc(Br)cc1
InChIInChI=1S/C15H15Br/c1-11-5-3-4-6-15(11)12(2)13-7-9-14(16)10-8-13/h3-10,12H,1-2H3
InChIKeyBFMIGQICNZDCQQ-UHFFFAOYSA-N
XLogP4.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.19
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-bromo-4-[bromo-(2-methylphenyl)methyl]benzene
CID 63439600
1-(4-bromophenyl)-N-[(1R)-1-(2-methylphenyl)ethyl]ethanamine
CID 81373795
1-bromo-4-[(2-methylphenyl)-nitrosomethyl]benzene
CID 142171176
3-amino-2-(4-bromophenyl)-1-(2-methylphenyl)propan-1-ol
CID 65186404
3-(4-bromophenyl)-3-(2-methylphenyl)propanoic acid
CID 67015622
1,3-dimethyl-2-[1-[2-(1-phenylethyl)phenyl]ethyl]benzene
CID 3024109
2-methyl-1,3-bis(1-phenylethyl)benzene
CID 58862393
1-methyl-3-(1-phenylethyl)-2-propan-2-ylbenzene
CID 18968375
4-bromo-N-[(1R)-1-(2-methylphenyl)ethyl]benzenesulfonamide
CID 26944548
(4-bromophenyl)-(2-iodo-3-methylphenyl)methanol
CID 114029440
1-bromo-4-[chloro-(2-chlorophenyl)methyl]benzene
CID 63429160
2,4-dimethyl-1-[1-(2-methylphenyl)ethyl]benzene
CID 54473191

Frequently Asked Questions

What is the IUPAC name of 1-bromo-4-[1-(2-methylphenyl)ethyl]benzene?
The IUPAC name of 1-bromo-4-[1-(2-methylphenyl)ethyl]benzene (CID 71518832) is 1-bromo-4-[1-(2-methylphenyl)ethyl]benzene.
What is the SMILES notation for 1-bromo-4-[1-(2-methylphenyl)ethyl]benzene?
The canonical SMILES for 1-bromo-4-[1-(2-methylphenyl)ethyl]benzene is Cc1ccccc1C(C)c1ccc(Br)cc1.
What is the InChIKey of 1-bromo-4-[1-(2-methylphenyl)ethyl]benzene?
The InChIKey is BFMIGQICNZDCQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Br/c1-11-5-3-4-6-15(11)12(2)13-7-9-14(16)10-8-13/h3-10,12H,1-2H3.
What are the key properties of 1-bromo-4-[1-(2-methylphenyl)ethyl]benzene?
1-bromo-4-[1-(2-methylphenyl)ethyl]benzene has a molecular weight of 275.19 g/mol, XLogP of 4.91, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-4-[1-(2-methylphenyl)ethyl]benzene is sourced from PubChem (CID 71518832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).