1-chloro-2-[(E)-2-cyclohexylethenyl]benzene

C14H17Cl — CID 101186675

IUPAC1-chloro-2-[(E)-2-cyclohexylethenyl]benzene
SMILESClc1ccccc1/C=C/C1CCCCC1
InChIInChI=1S/C14H17Cl/c15-14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h4-5,8-12H,1-3,6-7H2/b11-10+
InChIKeyGQARRWCCTCBKFQ-ZHACJKMWSA-N
MW220.74 g/mol
LogP4.93
Rot. Bonds2

About 1-chloro-2-[(E)-2-cyclohexylethenyl]benzene

1-chloro-2-[(E)-2-cyclohexylethenyl]benzene (PubChem CID 101186675) has the molecular formula C14H17Cl and a molecular weight of 220.74 g/mol. Its IUPAC name is 1-chloro-2-[(E)-2-cyclohexylethenyl]benzene.

Molecular Properties

Compound Name1-chloro-2-[(E)-2-cyclohexylethenyl]benzene
PubChem CID101186675
Molecular FormulaC14H17Cl
Molecular Weight220.74 g/mol
Exact Mass220.10
IUPAC Name1-chloro-2-[(E)-2-cyclohexylethenyl]benzene
SMILESClc1ccccc1/C=C/C1CCCCC1
InChIInChI=1S/C14H17Cl/c15-14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h4-5,8-12H,1-3,6-7H2/b11-10+
InChIKeyGQARRWCCTCBKFQ-ZHACJKMWSA-N
XLogP4.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.74
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 966037
(E)-3-(2-chlorophenyl)-N-cyclohexyl-N-ethylprop-2-enamide
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3-[(E)-2-(2-chlorophenyl)ethenyl]-1-cyclohexyl-1-methylurea
CID 108904598
1-[(E)-2-(2-chlorophenyl)ethenyl]-3-cyclododecylurea
CID 108904684
2-[(E)-2-cyclohexylethenyl]-N,N-di(propan-2-yl)benzamide
CID 154706947
6-(2-chlorophenyl)-2-[(E)-2-cyclohexylethenyl]-1H-benzimidazole
CID 57392158
3-[(E)-2-cyclohexylethenyl]-1-phenylindole
CID 10891968
1-[(E)-2-cyclohexylethenyl]-4-propan-2-ylbenzene
CID 11206940
2-chloro-5-(2-cyclohexylethenyl)benzamide
CID 171134570
[(E)-2-cyclohexylethenyl]-diphenylsulfanium
CID 140665581
(E)-3-(2-chlorophenyl)-N-[4-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]amino]cyclohexyl]prop-2-enamide
CID 6265521
2-cyclohexylethenylcyclohexane
CID 4124459

Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-[(E)-2-cyclohexylethenyl]benzene?
The IUPAC name of 1-chloro-2-[(E)-2-cyclohexylethenyl]benzene (CID 101186675) is 1-chloro-2-[(E)-2-cyclohexylethenyl]benzene.
What is the SMILES notation for 1-chloro-2-[(E)-2-cyclohexylethenyl]benzene?
The canonical SMILES for 1-chloro-2-[(E)-2-cyclohexylethenyl]benzene is Clc1ccccc1/C=C/C1CCCCC1.
What is the InChIKey of 1-chloro-2-[(E)-2-cyclohexylethenyl]benzene?
The InChIKey is GQARRWCCTCBKFQ-ZHACJKMWSA-N. The full InChI is InChI=1S/C14H17Cl/c15-14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h4-5,8-12H,1-3,6-7H2/b11-10+.
What are the key properties of 1-chloro-2-[(E)-2-cyclohexylethenyl]benzene?
1-chloro-2-[(E)-2-cyclohexylethenyl]benzene has a molecular weight of 220.74 g/mol, XLogP of 4.93, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-[(E)-2-cyclohexylethenyl]benzene is sourced from PubChem (CID 101186675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).