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1081-09-0

1081-09-0 | 3,5-Diacetyl-2,4,6-trimethyl-1,4-dihydropyridine

CAS No: 1081-09-0 Catalog No: AG003IKJ MDL No:

Product Description

Catalog Number:
AG003IKJ
Chemical Name:
3,5-Diacetyl-2,4,6-trimethyl-1,4-dihydropyridine
CAS Number:
1081-09-0
IUPAC Name:
1-(5-acetyl-2,4,6-trimethyl-1,4-dihydropyridin-3-yl)ethanone
InChI:
InChI=1S/C12H17NO2/c1-6-11(9(4)14)7(2)13-8(3)12(6)10(5)15/h6,13H,1-5H3
InChI Key:
BFHJJFUZJSTSBY-UHFFFAOYSA-N
EC Number:
214-099-5
NSC Number:
45011

Properties

Complexity:
352  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.126g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.273g/mol
Monoisotopic Mass:
207.126g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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