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115509-01-8 | Propanal, 2-[(tetrahydro-2H-pyran-2-yl)oxy]-, (2R)-
CAS No: 115509-01-8 Catalog No: AG000G31 MDL No:
Product Description
Catalog Number:
AG000G31
Chemical Name:
Propanal, 2-[(tetrahydro-2H-pyran-2-yl)oxy]-, (2R)-
CAS Number:
115509-01-8
Molecular Formula:
C8H14O3
Molecular Weight:
158.1950
IUPAC Name:
(2R)-2-(oxan-2-yloxy)propanal
InChI:
InChI=1S/C8H14O3/c1-7(6-9)11-8-4-2-3-5-10-8/h6-8H,2-5H2,1H3/t7-,8?/m1/s1
InChI Key:
QKUHRTGCQROYPJ-GVHYBUMESA-N
SMILES:
O=C[C@H](OC1CCCCO1)C
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
158.094g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.197g/mol
Monoisotopic Mass:
158.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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