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Home > Aldehydes > 879629-36-4
879629-36-4 | 2H-Pyran-2-carboxaldehyde, 3,4-dihydro-, (2S)-
CAS No: 879629-36-4 Catalog No: AG004D48 MDL No:
Product Description
Catalog Number:
AG004D48
Chemical Name:
2H-Pyran-2-carboxaldehyde, 3,4-dihydro-, (2S)-
CAS Number:
879629-36-4
Molecular Formula:
C6H8O2
Molecular Weight:
112.1265
IUPAC Name:
(2S)-3,4-dihydro-2H-pyran-2-carbaldehyde
InChI:
InChI=1S/C6H8O2/c7-5-6-3-1-2-4-8-6/h2,4-6H,1,3H2/t6-/m0/s1
InChI Key:
NPWYTMFWRRIFLK-LURJTMIESA-N
SMILES:
C1CC=CO[C@@H]1C=O
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
112.052g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
112.128g/mol
Monoisotopic Mass:
112.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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