1-[(2-chloro-4-methylphenyl)methoxy]naphthalene

C18H15ClO — CID 106870276

IUPAC1-[(2-chloro-4-methylphenyl)methoxy]naphthalene
SMILESCc1ccc(COc2cccc3ccccc23)c(Cl)c1
InChIInChI=1S/C18H15ClO/c1-13-9-10-15(17(19)11-13)12-20-18-8-4-6-14-5-2-3-7-16(14)18/h2-11H,12H2,1H3
InChIKeyUTHULYXCBCNAKI-UHFFFAOYSA-N
MW282.77 g/mol
LogP5.38
Rot. Bonds3

About 1-[(2-chloro-4-methylphenyl)methoxy]naphthalene

1-[(2-chloro-4-methylphenyl)methoxy]naphthalene (PubChem CID 106870276) has the molecular formula C18H15ClO and a molecular weight of 282.77 g/mol. Its IUPAC name is 1-[(2-chloro-4-methylphenyl)methoxy]naphthalene.

Molecular Properties

Compound Name1-[(2-chloro-4-methylphenyl)methoxy]naphthalene
PubChem CID106870276
Molecular FormulaC18H15ClO
Molecular Weight282.77 g/mol
Exact Mass282.08
IUPAC Name1-[(2-chloro-4-methylphenyl)methoxy]naphthalene
SMILESCc1ccc(COc2cccc3ccccc23)c(Cl)c1
InChIInChI=1S/C18H15ClO/c1-13-9-10-15(17(19)11-13)12-20-18-8-4-6-14-5-2-3-7-16(14)18/h2-11H,12H2,1H3
InChIKeyUTHULYXCBCNAKI-UHFFFAOYSA-N
XLogP5.38
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.77
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-chloro-1-[(2-ethylphenoxy)methyl]-4-methylbenzene
CID 106870271
3-chloro-4-(naphthalen-1-yloxymethyl)benzonitrile
CID 102665796
(1S)-1-[2-[(2-chloro-4-methylphenyl)methoxy]phenyl]ethanamine
CID 106861855
1-[[2-(chloromethyl)-4-methylphenoxy]methyl]naphthalene
CID 63536076
N-[[2-[(2-chloro-4-methylphenyl)methoxy]phenyl]methyl]ethanamine
CID 106861648
2-[(2-chloro-4-methylphenyl)methoxy]-5-methylaniline
CID 106861432
2-[(2-chloro-4-methylphenyl)methoxy]-4-methylaniline
CID 106861414
1-[(2,5-dimethylphenoxy)methyl]naphthalene
CID 78906369
[2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol
CID 106864412
2-[(2-chloro-4-methylphenyl)methoxy]-6-fluorobenzenecarbothioamide
CID 106863550
1-[(2-chloro-4-fluorophenyl)methoxy]-2,4-dimethylbenzene
CID 60627601
4-[(2-chloro-4-methylphenyl)methoxy]-3,5-dimethylaniline
CID 106861452

Frequently Asked Questions

What is the IUPAC name of 1-[(2-chloro-4-methylphenyl)methoxy]naphthalene?
The IUPAC name of 1-[(2-chloro-4-methylphenyl)methoxy]naphthalene (CID 106870276) is 1-[(2-chloro-4-methylphenyl)methoxy]naphthalene.
What is the SMILES notation for 1-[(2-chloro-4-methylphenyl)methoxy]naphthalene?
The canonical SMILES for 1-[(2-chloro-4-methylphenyl)methoxy]naphthalene is Cc1ccc(COc2cccc3ccccc23)c(Cl)c1.
What is the InChIKey of 1-[(2-chloro-4-methylphenyl)methoxy]naphthalene?
The InChIKey is UTHULYXCBCNAKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClO/c1-13-9-10-15(17(19)11-13)12-20-18-8-4-6-14-5-2-3-7-16(14)18/h2-11H,12H2,1H3.
What are the key properties of 1-[(2-chloro-4-methylphenyl)methoxy]naphthalene?
1-[(2-chloro-4-methylphenyl)methoxy]naphthalene has a molecular weight of 282.77 g/mol, XLogP of 5.38, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-chloro-4-methylphenyl)methoxy]naphthalene is sourced from PubChem (CID 106870276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).