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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)-

Carbamic acid, (cyanomethyl)-, phenylmethyl ester

N#CCNC(=O)OCc1ccccc1 Request for Quotation
Chemical Name: Carbamic acid, (cyanomethyl)-, phenylmethyl ester
CAS Number: 3589-41-1
Product Number: AG003SVK(AGN-PC-0JOHRT)
Synonyms:
MDL No:
Molecular Formula: C10H10N2O2
Molecular Weight: 190.1986

Identification/Properties

Properties
MP:
61-63 °C(lit.)
BP:
376.4°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
190.202g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
190.074g/mol
Monoisotopic Mass:
190.074g/mol
Topological Polar Surface Area:
62.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
226
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
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302+H312+H332
Precautionary Statements:
P280
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


Benzyl (cyanomethyl)carbamate, also known as BnCyanCB, is a versatile compound widely employed in chemical synthesis. In organic chemistry, it serves as a valuable building block for the introduction of both the benzyl and cyano groups into diverse molecules. Benzyl (cyanomethyl)carbamate is particularly valuable in the preparation of pharmaceutical intermediates and agrochemicals due to its reactivity and ability to introduce these functional groups in a controlled manner. This compound is commonly utilized in the synthesis of biologically active compounds, where the presence of both the benzyl and cyano moieties impart unique properties and enhance the overall efficacy of the target molecules. Its application extends to the preparation of specialty materials, fine chemicals, and advanced polymers, where precise control over the chemical structure is essential for obtaining desired properties. In summary, Benzyl (cyanomethyl)carbamate plays a crucial role in modern organic synthesis by enabling the efficient construction of complex molecules with tailored functionalities.