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155060-17-6 | 4H-1-Benzopyran-4-one, 3-azido-2,3-dihydro-
CAS No: 155060-17-6 Catalog No: AG001NLK MDL No:
Product Description
Catalog Number:
AG001NLK
Chemical Name:
4H-1-Benzopyran-4-one, 3-azido-2,3-dihydro-
CAS Number:
155060-17-6
Molecular Formula:
C9H7N3O2
Molecular Weight:
189.1708
IUPAC Name:
3-azido-2,3-dihydrochromen-4-one
InChI:
InChI=1S/C9H7N3O2/c10-12-11-7-5-14-8-4-2-1-3-6(8)9(7)13/h1-4,7H,5H2
InChI Key:
IZHKRIBZZHYXGV-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=NC1COc2c(C1=O)cccc2
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.054g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.174g/mol
Monoisotopic Mass:
189.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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