(Z)-1-chloro-2,6-dimethylhept-2-ene

C9H17Cl — CID 59072785

IUPAC(Z)-1-chloro-2,6-dimethylhept-2-ene
SMILESC/C(=C/CCC(C)C)CCl
InChIInChI=1S/C9H17Cl/c1-8(2)5-4-6-9(3)7-10/h6,8H,4-5,7H2,1-3H3/b9-6-
InChIKeyLVXXTEOODDVXAO-TWGQIWQCSA-N
MW160.69 g/mol
LogP3.61
Rot. Bonds4

About (Z)-1-chloro-2,6-dimethylhept-2-ene

(Z)-1-chloro-2,6-dimethylhept-2-ene (PubChem CID 59072785) has the molecular formula C9H17Cl and a molecular weight of 160.69 g/mol. Its IUPAC name is (Z)-1-chloro-2,6-dimethylhept-2-ene.

Molecular Properties

Compound Name(Z)-1-chloro-2,6-dimethylhept-2-ene
PubChem CID59072785
Molecular FormulaC9H17Cl
Molecular Weight160.69 g/mol
Exact Mass160.10
IUPAC Name(Z)-1-chloro-2,6-dimethylhept-2-ene
SMILESC/C(=C/CCC(C)C)CCl
InChIInChI=1S/C9H17Cl/c1-8(2)5-4-6-9(3)7-10/h6,8H,4-5,7H2,1-3H3/b9-6-
InChIKeyLVXXTEOODDVXAO-TWGQIWQCSA-N
XLogP3.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.69
LogP ≤ 53.61
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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Related Compounds

1-chloro-4,8-dimethylnon-3-ene
CID 83163373
(2Z,6Z)-1-chloro-12-methoxy-2,6,10-trimethyldodeca-2,6-diene
CID 88656729
(2E,6E)-1-chloro-2,6-dimethylocta-2,6-diene
CID 13409854
3,7,10-trimethylundec-3-ene
CID 91082560
1-chloro-4,6-dimethylhept-3-ene
CID 79603963
6,10-dimethylundec-5-en-2-ol
CID 57253097
(1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol
CID 141062858
(Z)-N,4,8-trimethylnon-3-en-1-amine
CID 83162608
(E)-2,6,10,13-tetramethyltetradec-6-ene
CID 58292425
(2Z,4E,8E,12E)-14-chloro-5,9,13-trimethyl-2-propan-2-yltetradeca-2,4,8,12-tetraen-1-ol
CID 10064869
11-chloro-6,10-dimethylundeca-5,9-dien-2-one
CID 173363850
(4E,8E,12E)-5,9,13,16-tetramethylheptadeca-4,8,12-triene
CID 23553717

Frequently Asked Questions

What is the IUPAC name of (Z)-1-chloro-2,6-dimethylhept-2-ene?
The IUPAC name of (Z)-1-chloro-2,6-dimethylhept-2-ene (CID 59072785) is (Z)-1-chloro-2,6-dimethylhept-2-ene.
What is the SMILES notation for (Z)-1-chloro-2,6-dimethylhept-2-ene?
The canonical SMILES for (Z)-1-chloro-2,6-dimethylhept-2-ene is C/C(=C/CCC(C)C)CCl.
What is the InChIKey of (Z)-1-chloro-2,6-dimethylhept-2-ene?
The InChIKey is LVXXTEOODDVXAO-TWGQIWQCSA-N. The full InChI is InChI=1S/C9H17Cl/c1-8(2)5-4-6-9(3)7-10/h6,8H,4-5,7H2,1-3H3/b9-6-.
What are the key properties of (Z)-1-chloro-2,6-dimethylhept-2-ene?
(Z)-1-chloro-2,6-dimethylhept-2-ene has a molecular weight of 160.69 g/mol, XLogP of 3.61, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-chloro-2,6-dimethylhept-2-ene is sourced from PubChem (CID 59072785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).