(2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane

C7H11Cl2F — CID 23234329

IUPAC(2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane
SMILESCC[C@]1(C)C(CCl)C1(F)Cl
InChIInChI=1S/C7H11Cl2F/c1-3-6(2)5(4-8)7(6,9)10/h5H,3-4H2,1-2H3/t5?,6-,7?/m1/s1
InChIKeyQFOSTRXNLXKEFB-YURFNIAASA-N
MW185.07 g/mol
LogP3.18
Rot. Bonds2

About (2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane

(2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane (PubChem CID 23234329) has the molecular formula C7H11Cl2F and a molecular weight of 185.07 g/mol. Its IUPAC name is (2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane.

Molecular Properties

Compound Name(2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane
PubChem CID23234329
Molecular FormulaC7H11Cl2F
Molecular Weight185.07 g/mol
Exact Mass184.02
IUPAC Name(2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane
SMILESCC[C@]1(C)C(CCl)C1(F)Cl
InChIInChI=1S/C7H11Cl2F/c1-3-6(2)5(4-8)7(6,9)10/h5H,3-4H2,1-2H3/t5?,6-,7?/m1/s1
InChIKeyQFOSTRXNLXKEFB-YURFNIAASA-N
XLogP3.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.07
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane?
The IUPAC name of (2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane (CID 23234329) is (2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane.
What is the SMILES notation for (2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane?
The canonical SMILES for (2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane is CC[C@]1(C)C(CCl)C1(F)Cl.
What is the InChIKey of (2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane?
The InChIKey is QFOSTRXNLXKEFB-YURFNIAASA-N. The full InChI is InChI=1S/C7H11Cl2F/c1-3-6(2)5(4-8)7(6,9)10/h5H,3-4H2,1-2H3/t5?,6-,7?/m1/s1.
What are the key properties of (2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane?
(2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane has a molecular weight of 185.07 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-chloro-3-(chloromethyl)-2-ethyl-1-fluoro-2-methylcyclopropane is sourced from PubChem (CID 23234329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).