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66109-88-4 | 4-Phenyltetrahydro-2H-pyran-4-carbaldehyde
CAS No: 66109-88-4 Catalog No: AG003LZM MDL No:MFCD08061006
Product Description
Catalog Number:
AG003LZM
Chemical Name:
4-Phenyltetrahydro-2H-pyran-4-carbaldehyde
CAS Number:
66109-88-4
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
MDL Number:
MFCD08061006
IUPAC Name:
4-phenyloxane-4-carbaldehyde
InChI:
InChI=1S/C12H14O2/c13-10-12(6-8-14-9-7-12)11-4-2-1-3-5-11/h1-5,10H,6-9H2
InChI Key:
IEIVCCVSMYLGOC-UHFFFAOYSA-N
SMILES:
O=CC1(CCOCC1)c1ccccc1
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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