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15970-40-8 | 1H-Imidazole-1,2-diamine, 4-phenyl-
CAS No: 15970-40-8 Catalog No: AG001RC8 MDL No:MFCD00778400
Product Description
Catalog Number:
AG001RC8
Chemical Name:
1H-Imidazole-1,2-diamine, 4-phenyl-
CAS Number:
15970-40-8
Molecular Formula:
C9H10N4
Molecular Weight:
174.2025
MDL Number:
MFCD00778400
IUPAC Name:
4-phenylimidazole-1,2-diamine
InChI:
InChI=1S/C9H10N4/c10-9-12-8(6-13(9)11)7-4-2-1-3-5-7/h1-6H,11H2,(H2,10,12)
InChI Key:
PDRGDRQVKOPWFY-UHFFFAOYSA-N
SMILES:
Nn1cc(nc1N)c1ccccc1
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.091g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
174.207g/mol
Monoisotopic Mass:
174.091g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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