7-(2-chlorophenyl)bicyclo[2.2.1]heptane

C13H15Cl — CID 10262419

IUPAC7-(2-chlorophenyl)bicyclo[2.2.1]heptane
SMILESClc1ccccc1C1C2CCC1CC2
InChIInChI=1S/C13H15Cl/c14-12-4-2-1-3-11(12)13-9-5-6-10(13)8-7-9/h1-4,9-10,13H,5-8H2
InChIKeySJLCZKUZDYYARB-UHFFFAOYSA-N
MW206.72 g/mol
LogP4.24
Rot. Bonds1

About 7-(2-chlorophenyl)bicyclo[2.2.1]heptane

7-(2-chlorophenyl)bicyclo[2.2.1]heptane (PubChem CID 10262419) has the molecular formula C13H15Cl and a molecular weight of 206.72 g/mol. Its IUPAC name is 7-(2-chlorophenyl)bicyclo[2.2.1]heptane.

Molecular Properties

Compound Name7-(2-chlorophenyl)bicyclo[2.2.1]heptane
PubChem CID10262419
Molecular FormulaC13H15Cl
Molecular Weight206.72 g/mol
Exact Mass206.09
IUPAC Name7-(2-chlorophenyl)bicyclo[2.2.1]heptane
SMILESClc1ccccc1C1C2CCC1CC2
InChIInChI=1S/C13H15Cl/c14-12-4-2-1-3-11(12)13-9-5-6-10(13)8-7-9/h1-4,9-10,13H,5-8H2
InChIKeySJLCZKUZDYYARB-UHFFFAOYSA-N
XLogP4.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.72
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[(2R,3S)-3-(2-chlorophenyl)-2-bicyclo[2.2.2]octanyl]methanamine
CID 70430746
(2S,3S)-3-(2-chlorophenyl)bicyclo[2.2.2]octane-2-carbonitrile
CID 18610714
(2R,3S)-3-chloro-2-(2-chlorophenyl)oxolane
CID 102201356
(2S)-2-(2-chlorophenyl)oxirane
CID 12561900
(2S)-2-(2-chlorophenyl)cyclobutan-1-one
CID 95240660
cis-(1S,2S)-2-(2-chlorophenyl)cyclopentan-1-ol
CID 94503761
4-(2-chlorophenyl)cyclohexan-1-one
CID 19705258
cis-(1R,2R)-2-(2-chlorophenyl)cyclopropan-1-amine
CID 39236190
3-(2-chlorophenyl)-7-azabicyclo[2.2.1]heptane-2-carboxylic acid
CID 117194104
cis-(1R,3S)-3-(2-chlorophenyl)cyclopentan-1-amine
CID 94680134
cis-(1R,2R)-2-(2-chlorophenyl)cyclopentan-1-amine
CID 94869146
3-(2-chlorophenyl)-1-methylazetidine
CID 167307075

Frequently Asked Questions

What is the IUPAC name of 7-(2-chlorophenyl)bicyclo[2.2.1]heptane?
The IUPAC name of 7-(2-chlorophenyl)bicyclo[2.2.1]heptane (CID 10262419) is 7-(2-chlorophenyl)bicyclo[2.2.1]heptane.
What is the SMILES notation for 7-(2-chlorophenyl)bicyclo[2.2.1]heptane?
The canonical SMILES for 7-(2-chlorophenyl)bicyclo[2.2.1]heptane is Clc1ccccc1C1C2CCC1CC2.
What is the InChIKey of 7-(2-chlorophenyl)bicyclo[2.2.1]heptane?
The InChIKey is SJLCZKUZDYYARB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl/c14-12-4-2-1-3-11(12)13-9-5-6-10(13)8-7-9/h1-4,9-10,13H,5-8H2.
What are the key properties of 7-(2-chlorophenyl)bicyclo[2.2.1]heptane?
7-(2-chlorophenyl)bicyclo[2.2.1]heptane has a molecular weight of 206.72 g/mol, XLogP of 4.24, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-chlorophenyl)bicyclo[2.2.1]heptane is sourced from PubChem (CID 10262419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).