1-chloro-4-methylbenzene;styrene

C15H15Cl — CID 158372531

IUPAC1-chloro-4-methylbenzene;styrene
SMILESC=Cc1ccccc1.Cc1ccc(Cl)cc1
InChIInChI=1S/C8H8.C7H7Cl/c1-2-8-6-4-3-5-7-8;1-6-2-4-7(8)5-3-6/h2-7H,1H2;2-5H,1H3
InChIKeyGUUCXZJWMUYSJE-UHFFFAOYSA-N
MW230.74 g/mol
LogP4.98
Rot. Bonds1

About 1-chloro-4-methylbenzene;styrene

1-chloro-4-methylbenzene;styrene (PubChem CID 158372531) has the molecular formula C15H15Cl and a molecular weight of 230.74 g/mol. Its IUPAC name is 1-chloro-4-methylbenzene;styrene.

Molecular Properties

Compound Name1-chloro-4-methylbenzene;styrene
PubChem CID158372531
Molecular FormulaC15H15Cl
Molecular Weight230.74 g/mol
Exact Mass230.09
IUPAC Name1-chloro-4-methylbenzene;styrene
SMILESC=Cc1ccccc1.Cc1ccc(Cl)cc1
InChIInChI=1S/C8H8.C7H7Cl/c1-2-8-6-4-3-5-7-8;1-6-2-4-7(8)5-3-6/h2-7H,1H2;2-5H,1H3
InChIKeyGUUCXZJWMUYSJE-UHFFFAOYSA-N
XLogP4.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.74
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethenyl-4-methylbenzene;styrene
CID 159659441
chloromethane;styrene
CID 122701035
1-chloro-4-ethenylbenzene;1-ethenyl-3-methylbenzene
CID 158114303
benzaldehyde;4-chlorobenzaldehyde;4-methylbenzaldehyde
CID 158703985
1-chloro-4-methylbenzene;ethane;toluene
CID 159482529
benzene;ethane;styrene
CID 21219610
1-chloro-4-ethenylbenzene;2-chloroethenylbenzene
CID 158705865
styrene;1,2-xylene;1,3-xylene;1,4-xylene
CID 160527972
CID 70443008
CID 70443008
1-ethenyl-4-methylbenzene;methane
CID 142136023
CID 174976037
CID 174976037
benzene;ethene;styrene
CID 159006852

Frequently Asked Questions

What is the IUPAC name of 1-chloro-4-methylbenzene;styrene?
The IUPAC name of 1-chloro-4-methylbenzene;styrene (CID 158372531) is 1-chloro-4-methylbenzene;styrene.
What is the SMILES notation for 1-chloro-4-methylbenzene;styrene?
The canonical SMILES for 1-chloro-4-methylbenzene;styrene is C=Cc1ccccc1.Cc1ccc(Cl)cc1.
What is the InChIKey of 1-chloro-4-methylbenzene;styrene?
The InChIKey is GUUCXZJWMUYSJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8.C7H7Cl/c1-2-8-6-4-3-5-7-8;1-6-2-4-7(8)5-3-6/h2-7H,1H2;2-5H,1H3.
What are the key properties of 1-chloro-4-methylbenzene;styrene?
1-chloro-4-methylbenzene;styrene has a molecular weight of 230.74 g/mol, XLogP of 4.98, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-4-methylbenzene;styrene is sourced from PubChem (CID 158372531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).