1-Butanone, 1-(3-pyridinyl)-


Chemical Name: 1-Butanone, 1-(3-pyridinyl)-
CAS Number: 1701-70-8
Product Number: AG00AR43(AGN-PC-007WTS)
Synonyms:
MDL No:
Molecular Formula: C9H11NO
Molecular Weight: 149.1897

Identification/Properties


Properties
BP:
253.4±13.0°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Computed Properties
Molecular Weight:
149.193g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
149.084g/mol
Monoisotopic Mass:
149.084g/mol
Topological Polar Surface Area:
30A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
134
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:
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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