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16326-65-1 | 2H-1-Benzopyran-2-one, 5,6,7,8-tetrahydro-
CAS No: 16326-65-1 Catalog No: AG001TY9 MDL No:
Product Description
Catalog Number:
AG001TY9
Chemical Name:
2H-1-Benzopyran-2-one, 5,6,7,8-tetrahydro-
CAS Number:
16326-65-1
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
IUPAC Name:
5,6,7,8-tetrahydrochromen-2-one
InChI:
InChI=1S/C9H10O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h5-6H,1-4H2
InChI Key:
TUCYOPUMAOACER-UHFFFAOYSA-N
SMILES:
O=c1ccc2c(o1)CCCC2
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.177g/mol
Monoisotopic Mass:
150.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Literature
| Title | Journal |
|---|---|
| Aromatase inhibitors from Broussonetia papyrifera. | Journal of natural products 20011001 |
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