Cyclopropanecarboxylic acid, 1-cyano-


Chemical Name: Cyclopropanecarboxylic acid, 1-cyano-
CAS Number: 6914-79-0
Product Number: AG003E8Y(AGN-PC-0KK5YL)
Synonyms:
MDL No:
Molecular Formula: C5H5NO2
Molecular Weight: 111.0987

Identification/Properties


Properties
MP:
140 °C(lit.)
BP:
142 °C
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Refractive Index:
1.4260 (estimate)
Computed Properties
Molecular Weight:
111.1g/mol
XLogP3:
0
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
111.032g/mol
Monoisotopic Mass:
111.032g/mol
Topological Polar Surface Area:
61.1A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
172
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:
Danger
UN#:
3261
Hazard Statements:
H302+H312+H332-H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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