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Home > Nitro Compounds > 14733-54-1
14733-54-1 | 2-Thiophenecarbonyl azide, 5-nitro-
CAS No: 14733-54-1 Catalog No: AG001ET3 MDL No:
Product Description
Catalog Number:
AG001ET3
Chemical Name:
2-Thiophenecarbonyl azide, 5-nitro-
CAS Number:
14733-54-1
Molecular Formula:
C5H2N4O3S
Molecular Weight:
198.1594
IUPAC Name:
5-nitrothiophene-2-carbonyl azide
InChI:
InChI=1S/C5H2N4O3S/c6-8-7-5(10)3-1-2-4(13-3)9(11)12/h1-2H
InChI Key:
MFYIVBBFYHXUOF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(s1)C(=O)N=[N+]=[N-]
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.985g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.156g/mol
Monoisotopic Mass:
197.985g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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