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65626-22-4 | 4-Methyltetrahydro-2H-pyran-4-carbaldehyde
CAS No: 65626-22-4 Catalog No: AG00370N MDL No:MFCD14582418
Product Description
Catalog Number:
AG00370N
Chemical Name:
4-Methyltetrahydro-2H-pyran-4-carbaldehyde
CAS Number:
65626-22-4
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
MDL Number:
MFCD14582418
IUPAC Name:
4-methyloxane-4-carbaldehyde
InChI:
InChI=1S/C7H12O2/c1-7(6-8)2-4-9-5-3-7/h6H,2-5H2,1H3
InChI Key:
XZWKQAMCAQYQGL-UHFFFAOYSA-N
SMILES:
O=CC1(C)CCOCC1
Properties
Complexity:
104
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:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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