Cas no 83412-73-1 ((6-chloro-3-pyridazinyl)methyl-Cyanamide)
83412-73-1 structure
Product Name:(6-chloro-3-pyridazinyl)methyl-Cyanamide
CAS No:83412-73-1
MF:C6H5ClN4
MW:168.583698987961
CID:1118472
PubChem ID:6409784
Update Time:2025-04-20
(6-chloro-3-pyridazinyl)methyl-Cyanamide Chemical and Physical Properties
Names and Identifiers
-
- (6-chloro-3-pyridazinyl)methyl-Cyanamide
- [(6-chloropyridazin-3-yl)(methyl)amino]methanenitrile
- (6-chloropyridazin-3-yl)-methylcyanamide
- 83412-73-1
-
- Inchi： 1S/C6H5ClN4/c1-11(4-8)6-3-2-5(7)9-10-6/h2-3H,1H3
- InChI Key： YZRFJLSZSWSQDN-UHFFFAOYSA-N
- SMILES： ClC1=CC=C(N=N1)N(C#N)C
Computed Properties
- Exact Mass: 168.0202739g/mol
- Monoisotopic Mass: 168.0202739g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 175
- 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
- XLogP3: 1
- Topological Polar Surface Area: 52.8?2
(6-chloro-3-pyridazinyl)methyl-Cyanamide Related Literature
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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