1-chloro-4-methoxynaphthalene

C11H9ClO — CID 606038

IUPAC1-chloro-4-methoxynaphthalene
SMILESCOc1ccc(Cl)c2ccccc12
InChIInChI=1S/C11H9ClO/c1-13-11-7-6-10(12)8-4-2-3-5-9(8)11/h2-7H,1H3
InChIKeyFKJJGFWMWLNSEG-UHFFFAOYSA-N
MW192.65 g/mol
LogP3.50
Rot. Bonds1

About 1-chloro-4-methoxynaphthalene

1-chloro-4-methoxynaphthalene (PubChem CID 606038) has the molecular formula C11H9ClO and a molecular weight of 192.65 g/mol. Its IUPAC name is 1-chloro-4-methoxynaphthalene.

Molecular Properties

Compound Name1-chloro-4-methoxynaphthalene
PubChem CID606038
Molecular FormulaC11H9ClO
Molecular Weight192.65 g/mol
Exact Mass192.03
IUPAC Name1-chloro-4-methoxynaphthalene
SMILESCOc1ccc(Cl)c2ccccc12
InChIInChI=1S/C11H9ClO/c1-13-11-7-6-10(12)8-4-2-3-5-9(8)11/h2-7H,1H3
InChIKeyFKJJGFWMWLNSEG-UHFFFAOYSA-N
XLogP3.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.65
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-chloro-9-methoxyphenanthrene
CID 174558891
4-(4-chloronaphthalen-1-yl)oxy-2-methoxyaniline
CID 63675956
2-chloro-1-methoxy-4-(4-methoxynaphthalen-1-yl)naphthalene
CID 165356371
1-methoxy-4-[4-(4-methoxynaphthalen-1-yl)oxyphenoxy]naphthalene
CID 146547657
8-chloro-1-methoxybenzo[e]pyrene
CID 12727109
1-bromo-4-methoxynaphthalene;ethane
CID 143974048
1-methoxy-4-(4-methoxynaphthalen-1-yl)sulfanylnaphthalene
CID 14147524
1-chloro-2-methoxybenzene
CID 13011
(4-chloronaphthalen-1-yl) 2-methylprop-2-enoate
CID 13195611
(5-chloro-2-methoxynaphthalen-1-yl)boronic acid
CID 168880110
1-chloro-4-(2-ethoxyethoxy)naphthalene
CID 112769647
1-methoxy-4-[2,2,2-trichloro-1-(4-methoxynaphthalen-1-yl)ethyl]naphthalene
CID 2202790

Frequently Asked Questions

What is the IUPAC name of 1-chloro-4-methoxynaphthalene?
The IUPAC name of 1-chloro-4-methoxynaphthalene (CID 606038) is 1-chloro-4-methoxynaphthalene.
What is the SMILES notation for 1-chloro-4-methoxynaphthalene?
The canonical SMILES for 1-chloro-4-methoxynaphthalene is COc1ccc(Cl)c2ccccc12.
What is the InChIKey of 1-chloro-4-methoxynaphthalene?
The InChIKey is FKJJGFWMWLNSEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClO/c1-13-11-7-6-10(12)8-4-2-3-5-9(8)11/h2-7H,1H3.
What are the key properties of 1-chloro-4-methoxynaphthalene?
1-chloro-4-methoxynaphthalene has a molecular weight of 192.65 g/mol, XLogP of 3.50, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-4-methoxynaphthalene is sourced from PubChem (CID 606038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).