(213C)prop-1-ene

C3H6 — CID 15621143

IUPAC(213C)prop-1-ene
SMILESC=[13CH]C
InChIInChI=1S/C3H6/c1-3-2/h3H,1H2,2H3/i3+1
InChIKeyQQONPFPTGQHPMA-LBPDFUHNSA-N
MW43.07 g/mol
LogP1.19
Rot. Bonds

About (213C)prop-1-ene

(213C)prop-1-ene (PubChem CID 15621143) has the molecular formula C3H6 and a molecular weight of 43.07 g/mol. Its IUPAC name is (213C)prop-1-ene.

Molecular Properties

Compound Name(213C)prop-1-ene
PubChem CID15621143
Molecular FormulaC3H6
Molecular Weight43.07 g/mol
Exact Mass43.05
IUPAC Name(213C)prop-1-ene
SMILESC=[13CH]C
InChIInChI=1S/C3H6/c1-3-2/h3H,1H2,2H3/i3+1
InChIKeyQQONPFPTGQHPMA-LBPDFUHNSA-N
XLogP1.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50043.07
LogP ≤ 51.19
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 (213C)prop-1-ene?
The IUPAC name of (213C)prop-1-ene (CID 15621143) is (213C)prop-1-ene.
What is the SMILES notation for (213C)prop-1-ene?
The canonical SMILES for (213C)prop-1-ene is C=[13CH]C.
What is the InChIKey of (213C)prop-1-ene?
The InChIKey is QQONPFPTGQHPMA-LBPDFUHNSA-N. The full InChI is InChI=1S/C3H6/c1-3-2/h3H,1H2,2H3/i3+1.
What are the key properties of (213C)prop-1-ene?
(213C)prop-1-ene has a molecular weight of 43.07 g/mol, XLogP of 1.19, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (213C)prop-1-ene is sourced from PubChem (CID 15621143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).