Cyclopentanecarboxylic acid, 1-cyano-


Chemical Name: Cyclopentanecarboxylic acid, 1-cyano-
CAS Number: 540490-54-8
Product Number: AG00DKKN(AGN-PC-0LWTER)
Synonyms:
MDL No:
Molecular Formula: C7H9NO2
Molecular Weight: 139.1519

Identification/Properties


Properties
BP:
330.2±25.0 °C(Predicted)
Storage:
Room Temperature;
Computed Properties
Molecular Weight:
139.154g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
139.063g/mol
Monoisotopic Mass:
139.063g/mol
Topological Polar Surface Area:
61.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
195
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#:
2811
Hazard Statements:
H301-H319-H412
Precautionary Statements:
P273-P301+P310-P305+P351+P338
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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