1,5-dichloro-3-ethyl-2-methoxybenzene

C9H10Cl2O — CID 71215672

IUPAC1,5-dichloro-3-ethyl-2-methoxybenzene
SMILESCCc1cc(Cl)cc(Cl)c1OC
InChIInChI=1S/C9H10Cl2O/c1-3-6-4-7(10)5-8(11)9(6)12-2/h4-5H,3H2,1-2H3
InChIKeyHPQLOOZQLPFQMN-UHFFFAOYSA-N
MW205.08 g/mol
LogP3.56
Rot. Bonds2

About 1,5-dichloro-3-ethyl-2-methoxybenzene

1,5-dichloro-3-ethyl-2-methoxybenzene (PubChem CID 71215672) has the molecular formula C9H10Cl2O and a molecular weight of 205.08 g/mol. Its IUPAC name is 1,5-dichloro-3-ethyl-2-methoxybenzene.

Molecular Properties

Compound Name1,5-dichloro-3-ethyl-2-methoxybenzene
PubChem CID71215672
Molecular FormulaC9H10Cl2O
Molecular Weight205.08 g/mol
Exact Mass204.01
IUPAC Name1,5-dichloro-3-ethyl-2-methoxybenzene
SMILESCCc1cc(Cl)cc(Cl)c1OC
InChIInChI=1S/C9H10Cl2O/c1-3-6-4-7(10)5-8(11)9(6)12-2/h4-5H,3H2,1-2H3
InChIKeyHPQLOOZQLPFQMN-UHFFFAOYSA-N
XLogP3.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.08
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,5-dichloro-3-(2-chloroethyl)-2-methoxybenzene
CID 82477195
(5-chloro-3-ethyl-2-methoxyphenyl)phosphane
CID 142101436
1-(2-bromoethyl)-3,5-dichloro-2-methoxybenzene
CID 82489523
1-(3,5-dichloro-2-methoxyphenyl)-N-methoxymethanamine
CID 117344115
1,5-dichloro-2-methoxy-3-(2,2,2-trifluoroethyl)benzene
CID 116932155
N-[(3,5-dichloro-2-methoxyphenyl)methyl]-2-methylpropan-2-amine;hydrochloride
CID 17290026
methyl N-[(3,5-dichloro-2-methoxyphenyl)methyl]carbamate
CID 110782986
(E)-4-(3,5-dichloro-2-methoxyphenyl)but-2-enoic acid
CID 116866031
N-[(3,5-dichloro-2-methoxyphenyl)methyl]carbamoyl bromide
CID 115193602
1-(5-chloro-3-ethyl-2-methoxyphenyl)propan-2-ol
CID 117329700
2-amino-3-(3,5-dichloro-2-methoxyphenyl)propanamide
CID 116850865
2-[(3,5-dichloro-2-methoxyphenyl)methyl-methylamino]acetaldehyde
CID 115223085

Frequently Asked Questions

What is the IUPAC name of 1,5-dichloro-3-ethyl-2-methoxybenzene?
The IUPAC name of 1,5-dichloro-3-ethyl-2-methoxybenzene (CID 71215672) is 1,5-dichloro-3-ethyl-2-methoxybenzene.
What is the SMILES notation for 1,5-dichloro-3-ethyl-2-methoxybenzene?
The canonical SMILES for 1,5-dichloro-3-ethyl-2-methoxybenzene is CCc1cc(Cl)cc(Cl)c1OC.
What is the InChIKey of 1,5-dichloro-3-ethyl-2-methoxybenzene?
The InChIKey is HPQLOOZQLPFQMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10Cl2O/c1-3-6-4-7(10)5-8(11)9(6)12-2/h4-5H,3H2,1-2H3.
What are the key properties of 1,5-dichloro-3-ethyl-2-methoxybenzene?
1,5-dichloro-3-ethyl-2-methoxybenzene has a molecular weight of 205.08 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dichloro-3-ethyl-2-methoxybenzene is sourced from PubChem (CID 71215672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).