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88861-43-2 | 2H-1-Benzopyran-2-one,4-(diazomethyl)-7-(diethylamino)-
CAS No: 88861-43-2 Catalog No: AG0049P8 MDL No:
Product Description
Catalog Number:
AG0049P8
Chemical Name:
2H-1-Benzopyran-2-one,4-(diazomethyl)-7-(diethylamino)-
CAS Number:
88861-43-2
Molecular Formula:
C14H15N3O2
Molecular Weight:
257.2878
IUPAC Name:
4-(diazomethyl)-7-(diethylamino)chromen-2-one
InChI:
InChI=1S/C14H15N3O2/c1-3-17(4-2)11-5-6-12-10(9-16-15)7-14(18)19-13(12)8-11/h5-9H,3-4H2,1-2H3
InChI Key:
BPJREJZJPCLZIP-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Cc1cc(=O)oc2c1ccc(c2)N(CC)CC
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.116g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.293g/mol
Monoisotopic Mass:
257.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
31.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.3
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