2-methyl(114C)prop-1-ene

C4H8 — CID 91412084

IUPAC2-methyl(114C)prop-1-ene
SMILESCC(C)=[14CH2]
InChIInChI=1S/C4H8/c1-4(2)3/h1H2,2-3H3/i1+2
InChIKeyVQTUBCCKSQIDNK-NJFSPNSNSA-N
MW58.10 g/mol
LogP1.58
Rot. Bonds

About 2-methyl(114C)prop-1-ene

2-methyl(114C)prop-1-ene (PubChem CID 91412084) has the molecular formula C4H8 and a molecular weight of 58.10 g/mol. Its IUPAC name is 2-methyl(114C)prop-1-ene.

Molecular Properties

Compound Name2-methyl(114C)prop-1-ene
PubChem CID91412084
Molecular FormulaC4H8
Molecular Weight58.10 g/mol
Exact Mass58.07
IUPAC Name2-methyl(114C)prop-1-ene
SMILESCC(C)=[14CH2]
InChIInChI=1S/C4H8/c1-4(2)3/h1H2,2-3H3/i1+2
InChIKeyVQTUBCCKSQIDNK-NJFSPNSNSA-N
XLogP1.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50058.10
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl(114C)prop-1-ene?
The IUPAC name of 2-methyl(114C)prop-1-ene (CID 91412084) is 2-methyl(114C)prop-1-ene.
What is the SMILES notation for 2-methyl(114C)prop-1-ene?
The canonical SMILES for 2-methyl(114C)prop-1-ene is CC(C)=[14CH2].
What is the InChIKey of 2-methyl(114C)prop-1-ene?
The InChIKey is VQTUBCCKSQIDNK-NJFSPNSNSA-N. The full InChI is InChI=1S/C4H8/c1-4(2)3/h1H2,2-3H3/i1+2.
What are the key properties of 2-methyl(114C)prop-1-ene?
2-methyl(114C)prop-1-ene has a molecular weight of 58.10 g/mol, XLogP of 1.58, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl(114C)prop-1-ene is sourced from PubChem (CID 91412084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).