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95633-27-5 | 2H-1-Benzopyran-2-one, 7-azido-4-methyl-
CAS No: 95633-27-5 Catalog No: AG01FL2K MDL No:
Product Description
Catalog Number:
AG01FL2K
Chemical Name:
2H-1-Benzopyran-2-one, 7-azido-4-methyl-
CAS Number:
95633-27-5
IUPAC Name:
7-azido-4-methylchromen-2-one
InChI:
InChI=1S/C10H7N3O2/c1-6-4-10(14)15-9-5-7(12-13-11)2-3-8(6)9/h2-5H,1H3
InChI Key:
HEKDKVLIMUWRRZ-UHFFFAOYSA-N
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.054g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.185g/mol
Monoisotopic Mass:
201.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| CYP2E1 active site residues in substrate recognition sequence 5 identified by photoaffinity labeling and homology modeling. | Archives of biochemistry and biophysics 20070301 |
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