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88328-77-2 | 2H-Pyran-2-one, 5,6-dihydro-6-methyl-4-(methylamino)-
CAS No: 88328-77-2 Catalog No: AG0047DD MDL No:
Product Description
Catalog Number:
AG0047DD
Chemical Name:
2H-Pyran-2-one, 5,6-dihydro-6-methyl-4-(methylamino)-
CAS Number:
88328-77-2
Molecular Formula:
C7H11NO2
Molecular Weight:
141.1677
IUPAC Name:
2-methyl-4-(methylamino)-2,3-dihydropyran-6-one
InChI:
InChI=1S/C7H11NO2/c1-5-3-6(8-2)4-7(9)10-5/h4-5,8H,3H2,1-2H3
InChI Key:
QXQKYBGPNHATDM-UHFFFAOYSA-N
SMILES:
CNC1=CC(=O)OC(C1)C
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.079g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
141.17g/mol
Monoisotopic Mass:
141.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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