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141854-32-2 | 2H-1,4-Oxazin-2-one, 5-chloro-3-(diethylamino)-6-methyl-
CAS No: 141854-32-2 Catalog No: AG001H9H MDL No:
Product Description
Catalog Number:
AG001H9H
Chemical Name:
2H-1,4-Oxazin-2-one, 5-chloro-3-(diethylamino)-6-methyl-
CAS Number:
141854-32-2
Molecular Formula:
C9H13ClN2O2
Molecular Weight:
216.6647
IUPAC Name:
5-chloro-3-(diethylamino)-6-methyl-1,4-oxazin-2-one
InChI:
InChI=1S/C9H13ClN2O2/c1-4-12(5-2)8-9(13)14-6(3)7(10)11-8/h4-5H2,1-3H3
InChI Key:
HTWBRRJOLIZRNY-UHFFFAOYSA-N
SMILES:
CCN(c1nc(Cl)c(oc1=O)C)CC
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.067g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.665g/mol
Monoisotopic Mass:
216.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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