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74189-56-3 | Benzaldehyde, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-
CAS No: 74189-56-3 Catalog No: AG005Z30 MDL No:MFCD02261777
Product Description
Catalog Number:
AG005Z30
Chemical Name:
Benzaldehyde, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-
CAS Number:
74189-56-3
Molecular Formula:
C12H14O3
Molecular Weight:
206.2378
MDL Number:
MFCD02261777
IUPAC Name:
4-(oxan-2-yloxy)benzaldehyde
InChI:
InChI=1S/C12H14O3/c13-9-10-4-6-11(7-5-10)15-12-3-1-2-8-14-12/h4-7,9,12H,1-3,8H2
InChI Key:
QYKABQMBXCBINA-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)OC1CCCCO1
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.094g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.241g/mol
Monoisotopic Mass:
206.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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