Benzaldehyde, 3-(2-pyrimidinyl)-


Chemical Name: Benzaldehyde, 3-(2-pyrimidinyl)-
CAS Number: 263349-22-0
Product Number: AG002SST(AGN-PC-03STKM)
Synonyms:
MDL No:
Molecular Formula: C11H8N2O
Molecular Weight: 184.1940

Identification/Properties


Computed Properties
Molecular Weight:
184.198g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
184.064g/mol
Monoisotopic Mass:
184.064g/mol
Topological Polar Surface Area:
42.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
190
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-H319
Precautionary Statements:
P264-P270-P280-P301+P312+P330-P305+P351+P338-P337+P313-P501
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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