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65626-23-5 | 4-Tetrahydropyranylacetaldehyde
CAS No: 65626-23-5 Catalog No: AG00345J MDL No:MFCD03425265
Product Description
Catalog Number:
AG00345J
Chemical Name:
4-Tetrahydropyranylacetaldehyde
CAS Number:
65626-23-5
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
MDL Number:
MFCD03425265
IUPAC Name:
2-(oxan-4-yl)acetaldehyde
InChI:
InChI=1S/C7H12O2/c8-4-1-7-2-5-9-6-3-7/h4,7H,1-3,5-6H2
InChI Key:
AUCJQPPZTFKDHI-UHFFFAOYSA-N
SMILES:
O=CCC1CCOCC1
Properties
Complexity:
84.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.171g/mol
Monoisotopic Mass:
128.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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