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Home > Aldehydes > 914365-68-7
914365-68-7 | 3-phenyloxolane-3-carbaldehyde
CAS No: 914365-68-7 Catalog No: AG01BG5H MDL No:MFCD24677961
Product Description
Catalog Number:
AG01BG5H
Chemical Name:
3-phenyloxolane-3-carbaldehyde
CAS Number:
914365-68-7
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
MDL Number:
MFCD24677961
IUPAC Name:
3-phenyloxolane-3-carbaldehyde
InChI:
InChI=1S/C11H12O2/c12-8-11(6-7-13-9-11)10-4-2-1-3-5-10/h1-5,8H,6-7,9H2
InChI Key:
MHIRTNVRQOESLH-UHFFFAOYSA-N
SMILES:
O=CC1(COCC1)c1ccccc1
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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