Naphthoxazine EthoxySilane

C14H14NO2Si — CID 137175570

IUPAC—
SMILESC1=Cc2c(ccc3ccccc23)ON1.CCO[Si]
InChIInChI=1S/C12H9NO.C2H5OSi/c1-2-4-10-9(3-1)5-6-12-11(10)7-8-13-14-12;1-2-3-4/h1-8,13H;2H2,1H3
InChIKeyBQJFCJDLRXXPMY-UHFFFAOYSA-N
MW256.36 g/mol
LogP2.81
Rot. Bonds1

About Naphthoxazine EthoxySilane

Naphthoxazine EthoxySilane (PubChem CID 137175570) has the molecular formula C14H14NO2Si and a molecular weight of 256.36 g/mol.

Molecular Properties

Compound NameNaphthoxazine EthoxySilane
PubChem CID137175570
Molecular FormulaC14H14NO2Si
Molecular Weight256.36 g/mol
Exact Mass256.08
IUPAC Name—
SMILESC1=Cc2c(ccc3ccccc23)ON1.CCO[Si]
InChIInChI=1S/C12H9NO.C2H5OSi/c1-2-4-10-9(3-1)5-6-12-11(10)7-8-13-14-12;1-2-3-4/h1-8,13H;2H2,1H3
InChIKeyBQJFCJDLRXXPMY-UHFFFAOYSA-N
XLogP2.81
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.36
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3H-benzo[f][1,2]benzoxazine;1H-pyrazole
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ethoxyethane;phenanthrene
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CID 15698543
3-methyl-3-phenylbenzo[f]chromene
CID 10849806
9,9-dimethylspiro[anthracene-10,3'-benzo[f]chromene]
CID 22084982
3-benzhydrylidenebenzo[f]chromene
CID 156788681
lithium;13-ethoxy-12,14-dioxa-13-aluminapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene;hydride
CID 70420201
ethyl acetate;phenanthrene
CID 160726264
1-ethoxy-2-methoxynaphthalene
CID 45093938
1-ethoxyspiro[1,2-dihydrobenzo[f]chromene-3,3'-pyrrolidine]
CID 82047282
2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene
CID 168858344
2-ethyl-1-(2-ethylnaphthalen-1-yl)oxynaphthalene
CID 23191166

Frequently Asked Questions

What is the IUPAC name of Naphthoxazine EthoxySilane?
The IUPAC name of Naphthoxazine EthoxySilane (CID 137175570) is not available.
What is the SMILES notation for Naphthoxazine EthoxySilane?
The canonical SMILES for Naphthoxazine EthoxySilane is C1=Cc2c(ccc3ccccc23)ON1.CCO[Si].
What is the InChIKey of Naphthoxazine EthoxySilane?
The InChIKey is BQJFCJDLRXXPMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9NO.C2H5OSi/c1-2-4-10-9(3-1)5-6-12-11(10)7-8-13-14-12;1-2-3-4/h1-8,13H;2H2,1H3.
What are the key properties of Naphthoxazine EthoxySilane?
Naphthoxazine EthoxySilane has a molecular weight of 256.36 g/mol, XLogP of 2.81, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for Naphthoxazine EthoxySilane is sourced from PubChem (CID 137175570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).