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30697-14-4 | Benzo[b]selenophene-2-carboxylic acid, 5-nitro-
CAS No: 30697-14-4 Catalog No: AG0030ZV MDL No:
Product Description
Catalog Number:
AG0030ZV
Chemical Name:
Benzo[b]selenophene-2-carboxylic acid, 5-nitro-
CAS Number:
30697-14-4
Molecular Formula:
C9H5NO4Se
Molecular Weight:
270.1003
IUPAC Name:
5-nitro-1-benzoselenophene-2-carboxylic acid
InChI:
InChI=1S/C9H5NO4Se/c11-9(12)8-4-5-3-6(10(13)14)1-2-7(5)15-8/h1-4H,(H,11,12)
InChI Key:
UJSGXXAHTWMTGC-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c([se]1)ccc(c2)[N+](=O)[O-]
NSC Number:
297544
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.938g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.113g/mol
Monoisotopic Mass:
270.938g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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