- Product Details
Keywords
- 1H-Imidazole-4,5-dicarboxylicacid, dihydrazide (9CI)
- 5423-20-1
- 98%
Quick Details
- ProName: 1H-Imidazole-4,5-dicarboxylicacid, dih...
- CasNo: 5423-20-1
- Molecular Formula: C5H8 N6 O2
- Appearance: Solid
- Application: Organic Chemicals
- DeliveryTime: According to client's demand quantity
- PackAge: as requested
- Port: SHANGHAI
- ProductionCapacity: 100 Kilogram/Month
- Purity: 99%
- Storage: Room Temperature
- Transportation: as requested
- LimitNum: 1 Gram
- Heavy metal: N/A
- Grade: Industrial Grade
Superiority
Details
Identification and Related Records
【Name】
1H-Imidazole-4,5-dicarboxylicacid, dihydrazide (9CI)
【Iupac name】
1H-imidazole-4,5-dicarbohydrazide
【CAS Registry number】
5423-20-1
【Synonyms】
Imidazole-4,5-dicarboxylicacid, dihydrazide (6CI,7CI,8CI)
NSC 10005
NSC 64855
【EINECS(EC#)】
226-550-3
【Molecular Formula】
C5H8 N6 O2 (Products with the same molecular formula)
【Molecular Weight】
184.15602
【Inchi】
InChI=1/C5H8N6O2/c6-10-4(12)2-3(5(13)11-7)9-1-8-2/h1H,6-7H2,(H,8,9)(H,10,12)(H,11,13)
【Canonical SMILES】
C1=NC(=C(N1)C(=O)NN)C(=O)NN
【MOL File】
5423-20-1.mol
Chemical and Physical Properties
【Density】
1.587g/cm3
【Boiling Point】
°Cat760mmHg
【Refractive Index】
1.679
【Flash Point】
°C
【Computed Properties】
Molecular Weight:184.15602 [g/mol]
Molecular Formula:C5H8N6O2
XLogP3-AA:-2.2
H-Bond Donor:5
H-Bond Acceptor:4
Rotatable Bond Count:2
Tautomer Count:22
Exact Mass:184.070874
MonoIsotopic Mass:184.070874
Topological Polar Surface Area:139
Heavy Atom Count:13
Formal Charge:0
Complexity:219
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Donor Count:5
Feature 3D Cation Count:1
Feature 3D Ring Count:1
Effective Rotor Count:4
Conformer Sampling RMSD:0.6
CID Conformer Count:7