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20194-70-1 | 2-Propanone, 1-(tetrahydro-4-methyl-2H-pyran-2-yl)-
CAS No: 20194-70-1 Catalog No: AG0027XB MDL No:
Product Description
Catalog Number:
AG0027XB
Chemical Name:
2-Propanone, 1-(tetrahydro-4-methyl-2H-pyran-2-yl)-
CAS Number:
20194-70-1
Molecular Formula:
C9H16O2
Molecular Weight:
156.2221
IUPAC Name:
1-(4-methyloxan-2-yl)propan-2-one
InChI:
InChI=1S/C9H16O2/c1-7-3-4-11-9(5-7)6-8(2)10/h7,9H,3-6H2,1-2H3
InChI Key:
LBOQZBRHNXPXIY-UHFFFAOYSA-N
SMILES:
CC1CCOC(C1)CC(=O)C
EC Number:
243-577-6
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.115g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.225g/mol
Monoisotopic Mass:
156.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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