2,3-dimethyl-4-methylideneheptane

C10H20 — CID 123725003

IUPAC2,3-dimethyl-4-methylideneheptane
SMILESC=C(CCC)C(C)C(C)C
InChIInChI=1S/C10H20/c1-6-7-9(4)10(5)8(2)3/h8,10H,4,6-7H2,1-3,5H3
InChIKeyCUSSMDHCHYXKPC-UHFFFAOYSA-N
MW140.27 g/mol
LogP3.63
Rot. Bonds4

About 2,3-dimethyl-4-methylideneheptane

2,3-dimethyl-4-methylideneheptane (PubChem CID 123725003) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is 2,3-dimethyl-4-methylideneheptane.

Molecular Properties

Compound Name2,3-dimethyl-4-methylideneheptane
PubChem CID123725003
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name2,3-dimethyl-4-methylideneheptane
SMILESC=C(CCC)C(C)C(C)C
InChIInChI=1S/C10H20/c1-6-7-9(4)10(5)8(2)3/h8,10H,4,6-7H2,1-3,5H3
InChIKeyCUSSMDHCHYXKPC-UHFFFAOYSA-N
XLogP3.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2,3,4-trimethyl-5-methylideneoct-1-ene
CID 91393907
4-methylidene-3-propan-2-ylhept-1-ene
CID 123221748
(3R)-2,3-dimethylheptan-4-one
CID 121285503
1-iodo-2-methylidenepentan-1-ol
CID 90371441
2,3-dimethylheptan-4-one
CID 19867142
5-methylidene-2-methylsulfanyl-4-propan-2-yloct-1-ene
CID 130432201
1-ethyl-2-(3-methyl-4-methylideneheptan-2-yl)cyclohexane
CID 123395792
4-chloro-5-methylideneoctane
CID 56986746
N-methyl-4-methylideneheptan-3-amine
CID 166854127
3-methylidene-2-(2-methylprop-1-enylsulfanyl)hexane
CID 138475249
1,1-dimethyl-2-(2,7,8-trimethyl-6-methylidenenonan-3-yl)cyclopropane
CID 123177166
4,5-dimethylideneoctane
CID 13294231

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-4-methylideneheptane?
The IUPAC name of 2,3-dimethyl-4-methylideneheptane (CID 123725003) is 2,3-dimethyl-4-methylideneheptane.
What is the SMILES notation for 2,3-dimethyl-4-methylideneheptane?
The canonical SMILES for 2,3-dimethyl-4-methylideneheptane is C=C(CCC)C(C)C(C)C.
What is the InChIKey of 2,3-dimethyl-4-methylideneheptane?
The InChIKey is CUSSMDHCHYXKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20/c1-6-7-9(4)10(5)8(2)3/h8,10H,4,6-7H2,1-3,5H3.
What are the key properties of 2,3-dimethyl-4-methylideneheptane?
2,3-dimethyl-4-methylideneheptane has a molecular weight of 140.27 g/mol, XLogP of 3.63, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-4-methylideneheptane is sourced from PubChem (CID 123725003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).