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Home > Aldehydes > 109123-57-1
109123-57-1 | 2,1,3-Benzoselenadiazole-4-carboxaldehyde
CAS No: 109123-57-1 Catalog No: AG0082T9 MDL No:
Product Description
Catalog Number:
AG0082T9
Chemical Name:
2,1,3-Benzoselenadiazole-4-carboxaldehyde
CAS Number:
109123-57-1
Molecular Formula:
C7H4N2OSe
Molecular Weight:
211.0795
IUPAC Name:
2,1,3-benzoselenadiazole-4-carbaldehyde
InChI:
InChI=1S/C7H4N2OSe/c10-4-5-2-1-3-6-7(5)9-11-8-6/h1-4H
InChI Key:
AYMCFIFOYXLNJO-UHFFFAOYSA-N
SMILES:
O=Cc1cccc2c1n[se]n2
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.949g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.093g/mol
Monoisotopic Mass:
211.949g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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