200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 101550-46-3
101550-46-3 | Dibenzoxepinone
CAS No: 101550-46-3 Catalog No: AG0004RY MDL No:
Product Description
Catalog Number:
AG0004RY
Chemical Name:
Dibenzoxepinone
CAS Number:
101550-46-3
Molecular Formula:
C14H10O2
Molecular Weight:
210.2280
IUPAC Name:
2H-benzo[d][1]benzoxepin-1-one
InChI:
InChI=1S/C14H10O2/c15-12-6-3-7-13-14(12)11-5-2-1-4-10(11)8-9-16-13/h1-5,7-9H,6H2
InChI Key:
MLGQCJSEUUWVLJ-UHFFFAOYSA-N
SMILES:
O=C1CC=CC2=C1c1ccccc1C=CO2
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.068g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.232g/mol
Monoisotopic Mass:
210.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.