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  2. Carbonic acid, compd. with phenylguanidineOTHER CA INDEX NAMES:Guanidine, phenyl-, carbonate

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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

Carbonic acid, compd. with phenylguanidineOTHER CA INDEX NAMES:Guanidine, phenyl-, carbonate

NC(=N)Nc1ccccc1.OC(=O)O Request for Quotation
Chemical Name: Carbonic acid, compd. with phenylguanidineOTHER CA INDEX NAMES:Guanidine, phenyl-, carbonate
CAS Number: 14018-90-7
Product Number: AG003TPP(AGN-PC-0PPCF0)
Synonyms:
MDL No:
Molecular Formula: C8H11N3O3
Molecular Weight: 197.1912

Identification/Properties

Properties
MP:
149-153 °C
BP:
428.8°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
197.194g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
197.08g/mol
Monoisotopic Mass:
197.08g/mol
Topological Polar Surface Area:
122A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
147
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:
2
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


1-Phenylguanidine xcarbonate is a versatile compound widely used in chemical synthesis due to its unique properties and reactivity. This compound serves as an effective reagent in various organic transformations, particularly in the formation of heterocyclic structures and pharmaceutical intermediates. Its high reactivity towards nucleophilic and electrophilic species makes it a valuable tool in the development of new chemical entities. In addition, 1-Phenylguanidine xcarbonate can be employed in the synthesis of organic salts, coordination complexes, and coordination polymers, showcasing its broad utility in modern organic chemistry research.