Home Other Building Blocks 4-Benzoyloxane

4-Benzoyloxane

CAS No.:
639468-72-7
Catalog Number:
AG00ELBX
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
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Product Description
Catalog Number:
AG00ELBX
Chemical Name:
4-Benzoyloxane
CAS Number:
639468-72-7
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
MDL Number:
MFCD16620356
IUPAC Name:
oxan-4-yl(phenyl)methanone
InChI:
InChI=1S/C12H14O2/c13-12(10-4-2-1-3-5-10)11-6-8-14-9-7-11/h1-5,11H,6-9H2
InChI Key:
GLRSKPCBJZOJGG-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)C1CCOCC1
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:
1.9  
Properties