(6R)-6-chloro-2-methylhept-2-ene

C8H15Cl — CID 129385268

IUPAC(6R)-6-chloro-2-methylhept-2-ene
SMILESCC(C)=CCC[C@@H](C)Cl
InChIInChI=1S/C8H15Cl/c1-7(2)5-4-6-8(3)9/h5,8H,4,6H2,1-3H3/t8-/m1/s1
InChIKeyMPUQSYDHMKFTGX-MRVPVSSYSA-N
MW146.66 g/mol
LogP3.36
Rot. Bonds3

About (6R)-6-chloro-2-methylhept-2-ene

(6R)-6-chloro-2-methylhept-2-ene (PubChem CID 129385268) has the molecular formula C8H15Cl and a molecular weight of 146.66 g/mol. Its IUPAC name is (6R)-6-chloro-2-methylhept-2-ene.

Molecular Properties

Compound Name(6R)-6-chloro-2-methylhept-2-ene
PubChem CID129385268
Molecular FormulaC8H15Cl
Molecular Weight146.66 g/mol
Exact Mass146.09
IUPAC Name(6R)-6-chloro-2-methylhept-2-ene
SMILESCC(C)=CCC[C@@H](C)Cl
InChIInChI=1S/C8H15Cl/c1-7(2)5-4-6-8(3)9/h5,8H,4,6H2,1-3H3/t8-/m1/s1
InChIKeyMPUQSYDHMKFTGX-MRVPVSSYSA-N
XLogP3.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.66
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (6R)-6-chloro-2-methylhept-2-ene?
The IUPAC name of (6R)-6-chloro-2-methylhept-2-ene (CID 129385268) is (6R)-6-chloro-2-methylhept-2-ene.
What is the SMILES notation for (6R)-6-chloro-2-methylhept-2-ene?
The canonical SMILES for (6R)-6-chloro-2-methylhept-2-ene is CC(C)=CCC[C@@H](C)Cl.
What is the InChIKey of (6R)-6-chloro-2-methylhept-2-ene?
The InChIKey is MPUQSYDHMKFTGX-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H15Cl/c1-7(2)5-4-6-8(3)9/h5,8H,4,6H2,1-3H3/t8-/m1/s1.
What are the key properties of (6R)-6-chloro-2-methylhept-2-ene?
(6R)-6-chloro-2-methylhept-2-ene has a molecular weight of 146.66 g/mol, XLogP of 3.36, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-chloro-2-methylhept-2-ene is sourced from PubChem (CID 129385268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).