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74772-18-2 | 2-Thiophenecarbonyl azide, 3-(1H-pyrrol-1-yl)-
CAS No: 74772-18-2 Catalog No: AG005HA4 MDL No:
Product Description
Catalog Number:
AG005HA4
Chemical Name:
2-Thiophenecarbonyl azide, 3-(1H-pyrrol-1-yl)-
CAS Number:
74772-18-2
Molecular Formula:
C9H6N4OS
Molecular Weight:
218.2351
IUPAC Name:
3-pyrrol-1-ylthiophene-2-carbonyl azide
InChI:
InChI=1S/C9H6N4OS/c10-12-11-9(14)8-7(3-6-15-8)13-4-1-2-5-13/h1-6H
InChI Key:
RWSVHUMXTCBTBP-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=NC(=O)c1sccc1n1cccc1
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.026g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.234g/mol
Monoisotopic Mass:
218.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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