1,5-dichloro-2,4-dimethylbenzene

C8H8Cl2 — CID 4174838

IUPAC1,5-dichloro-2,4-dimethylbenzene
SMILESCc1cc(C)c(Cl)cc1Cl
InChIInChI=1S/C8H8Cl2/c1-5-3-6(2)8(10)4-7(5)9/h3-4H,1-2H3
InChIKeySFPXVPWDXSCTBK-UHFFFAOYSA-N
MW175.06 g/mol
LogP3.61
Rot. Bonds

About 1,5-dichloro-2,4-dimethylbenzene

1,5-dichloro-2,4-dimethylbenzene (PubChem CID 4174838) has the molecular formula C8H8Cl2 and a molecular weight of 175.06 g/mol. Its IUPAC name is 1,5-dichloro-2,4-dimethylbenzene.

Molecular Properties

Compound Name1,5-dichloro-2,4-dimethylbenzene
PubChem CID4174838
Molecular FormulaC8H8Cl2
Molecular Weight175.06 g/mol
Exact Mass174.00
IUPAC Name1,5-dichloro-2,4-dimethylbenzene
SMILESCc1cc(C)c(Cl)cc1Cl
InChIInChI=1S/C8H8Cl2/c1-5-3-6(2)8(10)4-7(5)9/h3-4H,1-2H3
InChIKeySFPXVPWDXSCTBK-UHFFFAOYSA-N
XLogP3.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.06
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-chloro-5-methoxy-2,4-dimethylbenzene
CID 18683267
(2,4-dichloro-5-methylphenyl)boronic acid
CID 74888465
5-chloro-N,N,2,4-tetramethylaniline
CID 11959023
4-chloro-5-methylbenzene-1,2-diol
CID 23510503
1-chloro-5-methoxy-2,4-dimethylbenzene;ethane
CID 144758840
5-chloro-2,4-dimethylbenzaldehyde
CID 82645261
5-chloro-N,2,4-trimethylaniline;ethane
CID 145268863
5-chloro-2,4-dimethylbenzoyl chloride
CID 82633624
5-chloro-2,4-dimethylbenzamide
CID 82551019
2,4-dichloro-5-methylbenzoic acid;ethane
CID 145266813
1,5-dichloro-2-methyl-4-(2,2,2-trichloroethyl)benzene
CID 59488975
1,5-dichloro-2,3,4-trimethylbenzene
CID 21488192

Frequently Asked Questions

What is the IUPAC name of 1,5-dichloro-2,4-dimethylbenzene?
The IUPAC name of 1,5-dichloro-2,4-dimethylbenzene (CID 4174838) is 1,5-dichloro-2,4-dimethylbenzene.
What is the SMILES notation for 1,5-dichloro-2,4-dimethylbenzene?
The canonical SMILES for 1,5-dichloro-2,4-dimethylbenzene is Cc1cc(C)c(Cl)cc1Cl.
What is the InChIKey of 1,5-dichloro-2,4-dimethylbenzene?
The InChIKey is SFPXVPWDXSCTBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8Cl2/c1-5-3-6(2)8(10)4-7(5)9/h3-4H,1-2H3.
What are the key properties of 1,5-dichloro-2,4-dimethylbenzene?
1,5-dichloro-2,4-dimethylbenzene has a molecular weight of 175.06 g/mol, XLogP of 3.61, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dichloro-2,4-dimethylbenzene is sourced from PubChem (CID 4174838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).