3-(bromomethylidene)-2,2,4,4-tetramethylpentane

C10H19Br — CID 170849061

IUPAC3-(bromomethylidene)-2,2,4,4-tetramethylpentane
SMILESCC(C)(C)C(=CBr)C(C)(C)C
InChIInChI=1S/C10H19Br/c1-9(2,3)8(7-11)10(4,5)6/h7H,1-6H3
InChIKeyBXEHPNVUTPRTDN-UHFFFAOYSA-N
MW219.17 g/mol
LogP4.36
Rot. Bonds

About 3-(bromomethylidene)-2,2,4,4-tetramethylpentane

3-(bromomethylidene)-2,2,4,4-tetramethylpentane (PubChem CID 170849061) has the molecular formula C10H19Br and a molecular weight of 219.17 g/mol. Its IUPAC name is 3-(bromomethylidene)-2,2,4,4-tetramethylpentane.

Molecular Properties

Compound Name3-(bromomethylidene)-2,2,4,4-tetramethylpentane
PubChem CID170849061
Molecular FormulaC10H19Br
Molecular Weight219.17 g/mol
Exact Mass218.07
IUPAC Name3-(bromomethylidene)-2,2,4,4-tetramethylpentane
SMILESCC(C)(C)C(=CBr)C(C)(C)C
InChIInChI=1S/C10H19Br/c1-9(2,3)8(7-11)10(4,5)6/h7H,1-6H3
InChIKeyBXEHPNVUTPRTDN-UHFFFAOYSA-N
XLogP4.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.17
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3-(bromomethylidene)-2,2,4,4-tetramethylpentane?
The IUPAC name of 3-(bromomethylidene)-2,2,4,4-tetramethylpentane (CID 170849061) is 3-(bromomethylidene)-2,2,4,4-tetramethylpentane.
What is the SMILES notation for 3-(bromomethylidene)-2,2,4,4-tetramethylpentane?
The canonical SMILES for 3-(bromomethylidene)-2,2,4,4-tetramethylpentane is CC(C)(C)C(=CBr)C(C)(C)C.
What is the InChIKey of 3-(bromomethylidene)-2,2,4,4-tetramethylpentane?
The InChIKey is BXEHPNVUTPRTDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19Br/c1-9(2,3)8(7-11)10(4,5)6/h7H,1-6H3.
What are the key properties of 3-(bromomethylidene)-2,2,4,4-tetramethylpentane?
3-(bromomethylidene)-2,2,4,4-tetramethylpentane has a molecular weight of 219.17 g/mol, XLogP of 4.36, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(bromomethylidene)-2,2,4,4-tetramethylpentane is sourced from PubChem (CID 170849061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).