2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene

C15H14Cl2O2 — CID 43268073

IUPAC2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene
SMILESCOc1ccc(OCc2ccccc2Cl)c(CCl)c1
InChIInChI=1S/C15H14Cl2O2/c1-18-13-6-7-15(12(8-13)9-16)19-10-11-4-2-3-5-14(11)17/h2-8H,9-10H2,1H3
InChIKeyRVEXYKRLCBCKEZ-UHFFFAOYSA-N
MW297.18 g/mol
LogP4.67
Rot. Bonds5

About 2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene

2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene (PubChem CID 43268073) has the molecular formula C15H14Cl2O2 and a molecular weight of 297.18 g/mol. Its IUPAC name is 2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene.

Molecular Properties

Compound Name2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene
PubChem CID43268073
Molecular FormulaC15H14Cl2O2
Molecular Weight297.18 g/mol
Exact Mass296.04
IUPAC Name2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene
SMILESCOc1ccc(OCc2ccccc2Cl)c(CCl)c1
InChIInChI=1S/C15H14Cl2O2/c1-18-13-6-7-15(12(8-13)9-16)19-10-11-4-2-3-5-14(11)17/h2-8H,9-10H2,1H3
InChIKeyRVEXYKRLCBCKEZ-UHFFFAOYSA-N
XLogP4.67
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.18
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methanol
CID 43267981
1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
CID 60880037
N-[[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methyl]ethanamine
CID 60878145
2-(chloromethyl)-4-methoxy-1-[(4-methoxyphenyl)methoxy]benzene
CID 43268081
methyl 2-[(2-chlorophenyl)methoxy]-4-methoxybenzoate
CID 25235977
3-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]prop-2-yn-1-amine
CID 104706915
1,2,4-tris[(2-chlorophenyl)methoxy]benzene
CID 139941968
(NE)-N-[[2-[(2-chlorophenyl)methoxy]-4-methoxyphenyl]methylidene]hydroxylamine
CID 42315478
2,5-bis[(2-chlorophenyl)methoxy]phenol
CID 139941911
4-bromo-2-(chloromethyl)-1-[(2-methoxyphenyl)methoxy]benzene
CID 55225136
2-[[2-(chloromethyl)phenoxy]methyl]-1-methoxy-4-methylbenzene
CID 62161146
5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]-1,3-dimethoxybenzene
CID 43516801

Frequently Asked Questions

What is the IUPAC name of 2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene?
The IUPAC name of 2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene (CID 43268073) is 2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene.
What is the SMILES notation for 2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene?
The canonical SMILES for 2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene is COc1ccc(OCc2ccccc2Cl)c(CCl)c1.
What is the InChIKey of 2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene?
The InChIKey is RVEXYKRLCBCKEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2O2/c1-18-13-6-7-15(12(8-13)9-16)19-10-11-4-2-3-5-14(11)17/h2-8H,9-10H2,1H3.
What are the key properties of 2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene?
2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene has a molecular weight of 297.18 g/mol, XLogP of 4.67, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene is sourced from PubChem (CID 43268073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).