1-(chloromethyl)-1-prop-2-enylcyclopropane

C7H11Cl — CID 130618366

IUPAC1-(chloromethyl)-1-prop-2-enylcyclopropane
SMILESC=CCC1(CCl)CC1
InChIInChI=1S/C7H11Cl/c1-2-3-7(6-8)4-5-7/h2H,1,3-6H2
InChIKeyQFLQKXXPCZQJKQ-UHFFFAOYSA-N
MW130.62 g/mol
LogP2.58
Rot. Bonds3

About 1-(chloromethyl)-1-prop-2-enylcyclopropane

1-(chloromethyl)-1-prop-2-enylcyclopropane (PubChem CID 130618366) has the molecular formula C7H11Cl and a molecular weight of 130.62 g/mol. Its IUPAC name is 1-(chloromethyl)-1-prop-2-enylcyclopropane.

Molecular Properties

Compound Name1-(chloromethyl)-1-prop-2-enylcyclopropane
PubChem CID130618366
Molecular FormulaC7H11Cl
Molecular Weight130.62 g/mol
Exact Mass130.05
IUPAC Name1-(chloromethyl)-1-prop-2-enylcyclopropane
SMILESC=CCC1(CCl)CC1
InChIInChI=1S/C7H11Cl/c1-2-3-7(6-8)4-5-7/h2H,1,3-6H2
InChIKeyQFLQKXXPCZQJKQ-UHFFFAOYSA-N
XLogP2.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.62
LogP ≤ 52.58
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

1,1-bis(prop-2-enyl)cycloheptane
CID 90742385
(1-prop-2-enylcyclopropyl)methanol
CID 534677
2-(1-prop-2-enylcyclohexyl)acetaldehyde
CID 163359647
1,4-bis(prop-2-enyl)cyclohexane-1,4-diol
CID 15275260
4-ethyl-1,1-bis(prop-2-enyl)cyclohexane
CID 163799692
1-ethyl-1-prop-2-enylcyclobutane
CID 123404506
1-octyl-1-prop-2-enylcyclopropane
CID 134979265
4-(chloromethyl)-4-pent-4-enylcyclopentene
CID 165443647
1-(chloromethyl)-1-(fluoromethyl)cyclopropane
CID 22602666
1-prop-2-enylcyclododecan-1-ol
CID 11770111
1-prop-2-enylcyclooctan-1-ol
CID 12640793
1-prop-2-enylcyclodecan-1-ol
CID 102287484

Frequently Asked Questions

What is the IUPAC name of 1-(chloromethyl)-1-prop-2-enylcyclopropane?
The IUPAC name of 1-(chloromethyl)-1-prop-2-enylcyclopropane (CID 130618366) is 1-(chloromethyl)-1-prop-2-enylcyclopropane.
What is the SMILES notation for 1-(chloromethyl)-1-prop-2-enylcyclopropane?
The canonical SMILES for 1-(chloromethyl)-1-prop-2-enylcyclopropane is C=CCC1(CCl)CC1.
What is the InChIKey of 1-(chloromethyl)-1-prop-2-enylcyclopropane?
The InChIKey is QFLQKXXPCZQJKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11Cl/c1-2-3-7(6-8)4-5-7/h2H,1,3-6H2.
What are the key properties of 1-(chloromethyl)-1-prop-2-enylcyclopropane?
1-(chloromethyl)-1-prop-2-enylcyclopropane has a molecular weight of 130.62 g/mol, XLogP of 2.58, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(chloromethyl)-1-prop-2-enylcyclopropane is sourced from PubChem (CID 130618366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).