Home Other Building Blocks 7,9-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-5-one

7,9-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-5-one

CAS No.:
206435-79-2
Catalog Number:
AG01A08E
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01A08E
Chemical Name:
7,9-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-5-one
CAS Number:
206435-79-2
MDL Number:
MFCD01648764
IUPAC Name:
7,9-dimethyl-3,4-dihydro-2H-1-benzoxepin-5-one
InChI:
InChI=1S/C12H14O2/c1-8-6-9(2)12-10(7-8)11(13)4-3-5-14-12/h6-7H,3-5H2,1-2H3
InChI Key:
CPCFHNHUNWAKIZ-UHFFFAOYSA-N
Properties
Complexity:
224  
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:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties