Compound: Dicyandiamide
SMILES: N#CN=C(N)N
InChIKey: QGBSISYHAICWAH-UHFFFAOYSA-N
Synonyms: Dicyandiamide, CYANOGUANIDINE, 461-58-5, Dicyanodiamide, N-Cyanoguanidine, 1-Cyanoguanidine, Pyroset DO, Dicyandiamido, Dicyandiamin, Epicure DICY 7, Epicure DICY 15, Araldite HT 986, Bakelite VE 2560, Araldite XB 2879B, Araldite XB 2979B, ACR-H 3636, XB 2879B, DTXSID1020354, AI3-14632, M9B1R0C16H, NSC-2031, J3.635H, DTXCID50354, CHEBI:147423, RefChem:129060, 207-312-8, 2-Cyanoguanidine, Guanidine, cyano-, Metformin EP Impurity A, 3-cyanoguanidine, Guanidine-1-carbonitrile, NSC 2031, MFCD00008066, Guanidine, N-cyano-, NSC2031, aminocyanocarboxamidine, DCD, Dicyandiamin [German], Guanidine-15N3, cyano-15N-, CAS-461-58-5, Metformin impurity A, CCRIS 3478, HSDB 2126, Cyanoguanidine Metformin Related Compound A USP, EINECS 207-312-8, UNII-M9B1R0C16H, Dicyanadiamide, Dicyanediamide, cyano-guanidine, 1-cyano-guanidine, Cyanamide metabolite, Dicyandiamide, 99%, Dyhard 100S, Adeka EH 3636AS, Dicyanodiamide M.P. RS, Adeka EH 3636, Metformin impurity A CRS, DICYANODIAMIDE [MI], EC 207-312-8, SCHEMBL15222, SCHEMBL36859, CYANOGUANIDINE [HSDB], NCN=C(NH2)2, SCHEMBL291941, SCHEMBL315661, SCHEMBL705160, orb1705665, SCHEMBL4650690, CHEMBL3183942, SCHEMBL30886672, MSK6601, Tox21_201513, Tox21_302730, BBL009709, EBC-13140, SBB028162, STL141074, STL483054, AKOS000118777, AKOS005208673, CCG-214839, FC20647, NCGC00249058-01, NCGC00256355-01, NCGC00259063-01, 157480-33-6, BP-31003, CS-0015691, NS00003801, ST50409136, EN300-21430, D78355, F358292, Q905401, Dicyanodiamide (210 degrees C) Melting Point Standard, F0001-1248, METFORMIN HYDROCHLORIDE IMPURITY A [EP IMPURITY], Z203045078, InChI=1/C2H4N4/c3-1-6-2(4)5/h(H4,4,5,6, Cyanoguanidine, >=95.0% (HPLC), pharmaceutical impurity standard, Metformin impurity A, European Pharmacopoeia (EP) Reference Standard, 26591-10-6
Theoretical properties:
molecular_formula: C2H4N4
molecular_weight: 84.08 g/mol
exact_mass: 84.043596145 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 2
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 0
heavy_atom_count: 6
topological_polar_surface_area: 88.2 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: MONOCLINIC PRISMATIC CRYSTALS FROM WATER OR ALCOHOL
color: MONOCLINIC PRISMATIC CRYSTALS FROM WATER OR ALCOHOL
odor: Odorless
melting_point: 209.5 °C
density: 1.400 @ 25 °C/4 °C
solubility: SOLUBILITY IN H2O @ 13 °C: 2.26%; MORE SOL IN HOT H2O; SOLUBILITY IN ABS ETHANOL @ 13 °C: 1.26%, IN ETHER @ 13 °C: 0.01%; SOL IN LIQUID AMMONIA, INSOL IN BENZENE & CHLOROFORM
vapor_pressure: 0.000171 [mmHg]
Descriptions:
pubchem: Cyanoguanidine is a guanidine in which one of the amino hydrogens of guanidine itself is substituted by a cyano group. It is used in the manufacture of fertilizers, pharmaceuticals, explosives, oil well drilling muds, and dyestuffs. It has a role as a nitrification inhibitor, a fertilizer, an explosive, a curing agent and a flame retardant. It is a nitrile and a member of guanidines.
chebi: A guanidine in which one of the amino hydrogens of guanidine itself is substituted by a cyano group. It is used in the manufacture of fertilizers, pharmaceuticals, explosives, oil well drilling muds, and dyestuffs.
chembl: Unnamed Compound is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: 2-Cyanoguanidine is a nitrile derived from guanidine. It is a dimer of cyanamide, from which it can be prepared.