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158365-55-0

158365-55-0 | 7-Methoxynaphthalene-1-carboxaldehyde

CAS No: 158365-55-0 Catalog No: AG00ADL4 MDL No:MFCD17012526

Product Description

Catalog Number:
AG00ADL4
Chemical Name:
7-Methoxynaphthalene-1-carboxaldehyde
CAS Number:
158365-55-0
Molecular Formula:
C12H10O2
Molecular Weight:
186.2066
MDL Number:
MFCD17012526
IUPAC Name:
7-methoxynaphthalene-1-carbaldehyde
InChI:
InChI=1S/C12H10O2/c1-14-11-6-5-9-3-2-4-10(8-13)12(9)7-11/h2-8H,1H3
InChI Key:
WYDUFXRPFJPXGH-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(C=O)ccc2

Properties

Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.068g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.21g/mol
Monoisotopic Mass:
186.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

Literature

Title Journal
Activities of cytosolic aldehyde dehydrogenase isozymes in colon cancer: determination using selective, fluorimetric assays. Acta poloniae pharmaceutica 20050101

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