Carbamic acid, (cyanomethyl)-, 1,1-dimethylethyl ester


Chemical Name: Carbamic acid, (cyanomethyl)-, 1,1-dimethylethyl ester
CAS Number: 85363-04-8
Product Number: AG003SFB(AGN-PC-0JSO0N)
Synonyms:
MDL No: MFCD00239390
Molecular Formula: C7H12N2O2
Molecular Weight: 156.1824

Identification/Properties


Properties
MP:
53-57 °C
BP:
186°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.4880 (estimate)
Computed Properties
Molecular Weight:
156.185g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
156.09g/mol
Monoisotopic Mass:
156.09g/mol
Topological Polar Surface Area:
62.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
184
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#:
N/A
Hazard Statements:
H302+H312+H332
Precautionary Statements:
P280
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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