lithium;1-ethoxynaphthalene;hydride

C12H13LiO — CID 174613942

IUPAClithium;1-ethoxynaphthalene;hydride
SMILESCCOc1cccc2ccccc12.[H-].[Li+]
InChIInChI=1S/C12H12O.Li.H/c1-2-13-12-9-5-7-10-6-3-4-8-11(10)12;;/h3-9H,2H2,1H3;;/q;+1;-1
InChIKeyLAARDAAKQVMMRJ-UHFFFAOYSA-N
MW180.18 g/mol
LogP0.35
Rot. Bonds2

About lithium;1-ethoxynaphthalene;hydride

lithium;1-ethoxynaphthalene;hydride (PubChem CID 174613942) has the molecular formula C12H13LiO and a molecular weight of 180.18 g/mol. Its IUPAC name is lithium;1-ethoxynaphthalene;hydride.

Molecular Properties

Compound Namelithium;1-ethoxynaphthalene;hydride
PubChem CID174613942
Molecular FormulaC12H13LiO
Molecular Weight180.18 g/mol
Exact Mass180.11
IUPAC Namelithium;1-ethoxynaphthalene;hydride
SMILESCCOc1cccc2ccccc12.[H-].[Li+]
InChIInChI=1S/C12H12O.Li.H/c1-2-13-12-9-5-7-10-6-3-4-8-11(10)12;;/h3-9H,2H2,1H3;;/q;+1;-1
InChIKeyLAARDAAKQVMMRJ-UHFFFAOYSA-N
XLogP0.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.18
LogP ≤ 50.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethoxyphenanthrene
CID 19828992
1-butoxynaphthalene
CID 13262700
1-[2-[2-(4-ethoxyphenoxy)ethoxy]ethoxy]naphthalene
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1,7-diethoxynaphthalene
CID 13359547
4-ethoxynaphthalen-2-amine
CID 57115135
3-ethoxy-5-naphthalen-1-yloxyaniline
CID 80751912
1-ethoxy-5-propan-2-ylnaphthalene
CID 176668059
benzene;naphthalen-1-yloxymethanol
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1-(2-propylsulfonylethoxy)naphthalene
CID 106732634
naphthalen-1-yl 4-ethoxy-2,5-dimethylbenzenesulfonate
CID 139016113
1-(3-chloropropoxy)naphthalene
CID 12685615
N-(3,4-diethoxyphenyl)-2-naphthalen-1-yloxyacetamide
CID 7860223

Frequently Asked Questions

What is the IUPAC name of lithium;1-ethoxynaphthalene;hydride?
The IUPAC name of lithium;1-ethoxynaphthalene;hydride (CID 174613942) is lithium;1-ethoxynaphthalene;hydride.
What is the SMILES notation for lithium;1-ethoxynaphthalene;hydride?
The canonical SMILES for lithium;1-ethoxynaphthalene;hydride is CCOc1cccc2ccccc12.[H-].[Li+].
What is the InChIKey of lithium;1-ethoxynaphthalene;hydride?
The InChIKey is LAARDAAKQVMMRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O.Li.H/c1-2-13-12-9-5-7-10-6-3-4-8-11(10)12;;/h3-9H,2H2,1H3;;/q;+1;-1.
What are the key properties of lithium;1-ethoxynaphthalene;hydride?
lithium;1-ethoxynaphthalene;hydride has a molecular weight of 180.18 g/mol, XLogP of 0.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;1-ethoxynaphthalene;hydride is sourced from PubChem (CID 174613942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).