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15033-65-5 | 2-Propanone, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-
CAS No: 15033-65-5 Catalog No: AG001MIY MDL No:MFCD00210428
Product Description
Catalog Number:
AG001MIY
Chemical Name:
2-Propanone, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-
CAS Number:
15033-65-5
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
MDL Number:
MFCD00210428
IUPAC Name:
1-(2,3-dihydro-1,4-benzodioxin-6-yl)propan-2-one
InChI:
InChI=1S/C11H12O3/c1-8(12)6-9-2-3-10-11(7-9)14-5-4-13-10/h2-3,7H,4-6H2,1H3
InChI Key:
BKWCNNIPHHIQBS-UHFFFAOYSA-N
SMILES:
CC(=O)Cc1ccc2c(c1)OCCO2
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.214g/mol
Monoisotopic Mass:
192.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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