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69750-45-4

69750-45-4 | 1-Propanone, 1-(5-chloro-6-methoxy-2-naphthalenyl)-

CAS No: 69750-45-4 Catalog No: AG005I9G MDL No:

Product Description

Catalog Number:
AG005I9G
Chemical Name:
1-Propanone, 1-(5-chloro-6-methoxy-2-naphthalenyl)-
CAS Number:
69750-45-4
Molecular Formula:
C14H13ClO2
Molecular Weight:
248.7048
IUPAC Name:
1-(5-chloro-6-methoxynaphthalen-2-yl)propan-1-one
InChI:
InChI=1S/C14H13ClO2/c1-3-12(16)10-4-6-11-9(8-10)5-7-13(17-2)14(11)15/h4-8H,3H2,1-2H3
InChI Key:
PSHXIXVKAXBEOJ-UHFFFAOYSA-N
SMILES:
CCC(=O)c1ccc2c(c1)ccc(c2Cl)OC

Properties

Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.06g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.706g/mol
Monoisotopic Mass:
248.06g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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