Cas no 883883-48-5 (1,3-Benzenediamine, 4-methyl-5-nitroso-)
883883-48-5 structure
Product Name:1,3-Benzenediamine, 4-methyl-5-nitroso-
CAS No:883883-48-5
MF:C7H9N3O
MW:151.165860891342
CID:710450
Update Time:2024-01-31
1,3-Benzenediamine, 4-methyl-5-nitroso- Chemical and Physical Properties
Names and Identifiers
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- 1,3-Benzenediamine, 4-methyl-5-nitroso-
- 1,3-Benzenediamine, 4-methyl-5-nitroso-
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- Inchi： 1S/C7H9N3O/c1-4-6(9)2-5(8)3-7(4)10-11/h2-3H,8-9H2,1H3
- InChI Key： VPJORBQFPBPLDB-UHFFFAOYSA-N
- SMILES： C1(N)=CC(N=O)=C(C)C(N)=C1
Computed Properties
- Exact Mass: 151.075
- Monoisotopic Mass: 151.075
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 151
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 81.5A^2
1,3-Benzenediamine, 4-methyl-5-nitroso- Related Literature
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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