alumane;2-phenylethylbenzene;hydrobromide

C14H18AlBr — CID 173446278

IUPACalumane;2-phenylethylbenzene;hydrobromide
SMILESBr.[AlH3].c1ccc(CCc2ccccc2)cc1
InChIInChI=1S/C14H14.Al.BrH.3H/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14;;;;;/h1-10H,11-12H2;;1H;;;
InChIKeyPGAATYYUELGJNB-UHFFFAOYSA-N
MW293.18 g/mol
LogP2.87
Rot. Bonds3

About alumane;2-phenylethylbenzene;hydrobromide

alumane;2-phenylethylbenzene;hydrobromide (PubChem CID 173446278) has the molecular formula C14H18AlBr and a molecular weight of 293.18 g/mol. Its IUPAC name is alumane;2-phenylethylbenzene;hydrobromide.

Molecular Properties

Compound Namealumane;2-phenylethylbenzene;hydrobromide
PubChem CID173446278
Molecular FormulaC14H18AlBr
Molecular Weight293.18 g/mol
Exact Mass292.04
IUPAC Namealumane;2-phenylethylbenzene;hydrobromide
SMILESBr.[AlH3].c1ccc(CCc2ccccc2)cc1
InChIInChI=1S/C14H14.Al.BrH.3H/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14;;;;;/h1-10H,11-12H2;;1H;;;
InChIKeyPGAATYYUELGJNB-UHFFFAOYSA-N
XLogP2.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.18
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

benzene;2-phenylethylbenzene
CID 18982764
hafnium;2-phenylethylbenzene
CID 173109801
ethane;methane;2-phenylethylbenzene
CID 158652330
1-benzyl-4-[2-(4-benzylphenyl)ethyl]benzene
CID 23565947
4-phenylbutylbenzene
CID 141301927
propylbenzene;hydrobromide
CID 70024036
hafnium;4-phenylbutylbenzene
CID 175889972
1,4-bis(3-phenylpropyl)benzene
CID 59467322
methane;4-phenylbutylbenzene
CID 173386802
CID 159131095
CID 159131095
2-[4-(2-phenylethyl)phenyl]ethanamine
CID 15036636
[4-(2-phenylethyl)phenyl]methanethiol
CID 88715402

Frequently Asked Questions

What is the IUPAC name of alumane;2-phenylethylbenzene;hydrobromide?
The IUPAC name of alumane;2-phenylethylbenzene;hydrobromide (CID 173446278) is alumane;2-phenylethylbenzene;hydrobromide.
What is the SMILES notation for alumane;2-phenylethylbenzene;hydrobromide?
The canonical SMILES for alumane;2-phenylethylbenzene;hydrobromide is Br.[AlH3].c1ccc(CCc2ccccc2)cc1.
What is the InChIKey of alumane;2-phenylethylbenzene;hydrobromide?
The InChIKey is PGAATYYUELGJNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14.Al.BrH.3H/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14;;;;;/h1-10H,11-12H2;;1H;;;.
What are the key properties of alumane;2-phenylethylbenzene;hydrobromide?
alumane;2-phenylethylbenzene;hydrobromide has a molecular weight of 293.18 g/mol, XLogP of 2.87, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;2-phenylethylbenzene;hydrobromide is sourced from PubChem (CID 173446278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).