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116433-49-9 | Acetamide, 2-azido-N-(4-methylphenyl)-
CAS No: 116433-49-9 Catalog No: AG000CI2 MDL No:MFCD14652267
Product Description
Catalog Number:
AG000CI2
Chemical Name:
Acetamide, 2-azido-N-(4-methylphenyl)-
CAS Number:
116433-49-9
Molecular Formula:
C9H10N4O
Molecular Weight:
190.2019
MDL Number:
MFCD14652267
IUPAC Name:
2-azido-N-(4-methylphenyl)acetamide
InChI:
InChI=1S/C9H10N4O/c1-7-2-4-8(5-3-7)12-9(14)6-11-13-10/h2-5H,6H2,1H3,(H,12,14)
InChI Key:
CCDGBERUXHSSKZ-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)C)CN=[N+]=[N-]
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.206g/mol
Monoisotopic Mass:
190.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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