1,2-xylene;tetrahydrobromide

C8H14Br4 — CID 172843014

IUPAC1,2-xylene;tetrahydrobromide
SMILESBr.Br.Br.Br.Cc1ccccc1C
InChIInChI=1S/C8H10.4BrH/c1-7-5-3-4-6-8(7)2;;;;/h3-6H,1-2H3;4*1H
InChIKeyXAZAOQIHQKGPCT-UHFFFAOYSA-N
MW429.82 g/mol
LogP4.62
Rot. Bonds

About 1,2-xylene;tetrahydrobromide

1,2-xylene;tetrahydrobromide (PubChem CID 172843014) has the molecular formula C8H14Br4 and a molecular weight of 429.82 g/mol. Its IUPAC name is 1,2-xylene;tetrahydrobromide.

Molecular Properties

Compound Name1,2-xylene;tetrahydrobromide
PubChem CID172843014
Molecular FormulaC8H14Br4
Molecular Weight429.82 g/mol
Exact Mass425.78
IUPAC Name1,2-xylene;tetrahydrobromide
SMILESBr.Br.Br.Br.Cc1ccccc1C
InChIInChI=1S/C8H10.4BrH/c1-7-5-3-4-6-8(7)2;;;;/h3-6H,1-2H3;4*1H
InChIKeyXAZAOQIHQKGPCT-UHFFFAOYSA-N
XLogP4.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.82
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,2-xylene
CID 173422016
benzene;1,2-xylene
CID 161464493
1,2-xylene;trihydrochloride
CID 70594732
vanadium;1,2-xylene
CID 143581691
1,2-xylene;zirconium
CID 174354618
silver;1,2-xylene
CID 158486133
azane;1,2-xylene
CID 174280305
CID 174747854
CID 174747854
ethane;methane;pentakis(1,2-xylene)
CID 158909718
ethane;1,2-xylene;dihydrochloride
CID 174677530
acetylene;1,2-xylene
CID 175515922
sodium;hydride;1,2-xylene
CID 173009635

Frequently Asked Questions

What is the IUPAC name of 1,2-xylene;tetrahydrobromide?
The IUPAC name of 1,2-xylene;tetrahydrobromide (CID 172843014) is 1,2-xylene;tetrahydrobromide.
What is the SMILES notation for 1,2-xylene;tetrahydrobromide?
The canonical SMILES for 1,2-xylene;tetrahydrobromide is Br.Br.Br.Br.Cc1ccccc1C.
What is the InChIKey of 1,2-xylene;tetrahydrobromide?
The InChIKey is XAZAOQIHQKGPCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10.4BrH/c1-7-5-3-4-6-8(7)2;;;;/h3-6H,1-2H3;4*1H.
What are the key properties of 1,2-xylene;tetrahydrobromide?
1,2-xylene;tetrahydrobromide has a molecular weight of 429.82 g/mol, XLogP of 4.62, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-xylene;tetrahydrobromide is sourced from PubChem (CID 172843014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).