1-chloro-6-methyl-2-phenylmethoxynaphthalene

C18H15ClO — CID 143228673

IUPAC1-chloro-6-methyl-2-phenylmethoxynaphthalene
SMILESCc1ccc2c(Cl)c(OCc3ccccc3)ccc2c1
InChIInChI=1S/C18H15ClO/c1-13-7-9-16-15(11-13)8-10-17(18(16)19)20-12-14-5-3-2-4-6-14/h2-11H,12H2,1H3
InChIKeyJWHFFXGIPDOEIM-UHFFFAOYSA-N
MW282.77 g/mol
LogP5.38
Rot. Bonds3

About 1-chloro-6-methyl-2-phenylmethoxynaphthalene

1-chloro-6-methyl-2-phenylmethoxynaphthalene (PubChem CID 143228673) has the molecular formula C18H15ClO and a molecular weight of 282.77 g/mol. Its IUPAC name is 1-chloro-6-methyl-2-phenylmethoxynaphthalene.

Molecular Properties

Compound Name1-chloro-6-methyl-2-phenylmethoxynaphthalene
PubChem CID143228673
Molecular FormulaC18H15ClO
Molecular Weight282.77 g/mol
Exact Mass282.08
IUPAC Name1-chloro-6-methyl-2-phenylmethoxynaphthalene
SMILESCc1ccc2c(Cl)c(OCc3ccccc3)ccc2c1
InChIInChI=1S/C18H15ClO/c1-13-7-9-16-15(11-13)8-10-17(18(16)19)20-12-14-5-3-2-4-6-14/h2-11H,12H2,1H3
InChIKeyJWHFFXGIPDOEIM-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

6,19-dimethyl-5,20-bis(phenylmethoxy)pentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene
CID 102507798
2-methyl-7-phenylmethoxynaphthalene
CID 90146760
2-(bromomethyl)-4-methyl-1-phenylmethoxybenzene
CID 14885530
1-iodo-4-methyl-2-phenylmethoxybenzene
CID 134208884
5-methyl-2-phenylmethoxybenzaldehyde
CID 1247883
N-chloro-4-methyl-2-phenylmethoxyaniline
CID 87749280
2-methyl-4-(4-methylphenyl)-1-phenylmethoxybenzene
CID 142190093
6-methylnaphthalen-2-ol;2-methyl-6-phenylmethoxynaphthalene
CID 158113747
ethane;5-methyl-2-phenylmethoxybenzaldehyde
CID 142857349
1-chloro-6-methyl-4-phenylmethoxyphthalazine;ethane
CID 156651172
2-[(3-methylphenyl)methoxy]-1-phenylnaphthalene
CID 132584959
2,3,6,7,10,11-hexakis(phenylmethoxy)triphenylene
CID 11040205

Frequently Asked Questions

What is the IUPAC name of 1-chloro-6-methyl-2-phenylmethoxynaphthalene?
The IUPAC name of 1-chloro-6-methyl-2-phenylmethoxynaphthalene (CID 143228673) is 1-chloro-6-methyl-2-phenylmethoxynaphthalene.
What is the SMILES notation for 1-chloro-6-methyl-2-phenylmethoxynaphthalene?
The canonical SMILES for 1-chloro-6-methyl-2-phenylmethoxynaphthalene is Cc1ccc2c(Cl)c(OCc3ccccc3)ccc2c1.
What is the InChIKey of 1-chloro-6-methyl-2-phenylmethoxynaphthalene?
The InChIKey is JWHFFXGIPDOEIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClO/c1-13-7-9-16-15(11-13)8-10-17(18(16)19)20-12-14-5-3-2-4-6-14/h2-11H,12H2,1H3.
What are the key properties of 1-chloro-6-methyl-2-phenylmethoxynaphthalene?
1-chloro-6-methyl-2-phenylmethoxynaphthalene 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-chloro-6-methyl-2-phenylmethoxynaphthalene is sourced from PubChem (CID 143228673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).