1-chloro-3-(cyclopentylidenemethyl)benzene

C12H13Cl — CID 121281215

IUPAC1-chloro-3-(cyclopentylidenemethyl)benzene
SMILESClc1cccc(C=C2CCCC2)c1
InChIInChI=1S/C12H13Cl/c13-12-7-3-6-11(9-12)8-10-4-1-2-5-10/h3,6-9H,1-2,4-5H2
InChIKeyZASFDCRTMFBAFX-UHFFFAOYSA-N
MW192.69 g/mol
LogP4.30
Rot. Bonds1

About 1-chloro-3-(cyclopentylidenemethyl)benzene

1-chloro-3-(cyclopentylidenemethyl)benzene (PubChem CID 121281215) has the molecular formula C12H13Cl and a molecular weight of 192.69 g/mol. Its IUPAC name is 1-chloro-3-(cyclopentylidenemethyl)benzene.

Molecular Properties

Compound Name1-chloro-3-(cyclopentylidenemethyl)benzene
PubChem CID121281215
Molecular FormulaC12H13Cl
Molecular Weight192.69 g/mol
Exact Mass192.07
IUPAC Name1-chloro-3-(cyclopentylidenemethyl)benzene
SMILESClc1cccc(C=C2CCCC2)c1
InChIInChI=1S/C12H13Cl/c13-12-7-3-6-11(9-12)8-10-4-1-2-5-10/h3,6-9H,1-2,4-5H2
InChIKeyZASFDCRTMFBAFX-UHFFFAOYSA-N
XLogP4.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.69
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-chloro-3-(cyclopentylidenemethyl)benzene?
The IUPAC name of 1-chloro-3-(cyclopentylidenemethyl)benzene (CID 121281215) is 1-chloro-3-(cyclopentylidenemethyl)benzene.
What is the SMILES notation for 1-chloro-3-(cyclopentylidenemethyl)benzene?
The canonical SMILES for 1-chloro-3-(cyclopentylidenemethyl)benzene is Clc1cccc(C=C2CCCC2)c1.
What is the InChIKey of 1-chloro-3-(cyclopentylidenemethyl)benzene?
The InChIKey is ZASFDCRTMFBAFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13Cl/c13-12-7-3-6-11(9-12)8-10-4-1-2-5-10/h3,6-9H,1-2,4-5H2.
What are the key properties of 1-chloro-3-(cyclopentylidenemethyl)benzene?
1-chloro-3-(cyclopentylidenemethyl)benzene has a molecular weight of 192.69 g/mol, XLogP of 4.30, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-3-(cyclopentylidenemethyl)benzene is sourced from PubChem (CID 121281215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).