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Home > Aldehydes > 1187933-19-2
1187933-19-2 | 4-Amino-Pyridine-3-Carbaldehyde Trifluoroacetate
CAS No: 1187933-19-2 Catalog No: AG01DTRN MDL No:MFCD09701202
Product Description
Catalog Number:
AG01DTRN
Chemical Name:
4-Amino-Pyridine-3-Carbaldehyde Trifluoroacetate
CAS Number:
1187933-19-2
Molecular Formula:
C8H7F3N2O3
Molecular Weight:
236.1480
MDL Number:
MFCD09701202
IUPAC Name:
4-aminopyridine-3-carbaldehyde;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C6H6N2O.C2HF3O2/c7-6-1-2-8-3-5(6)4-9;3-2(4,5)1(6)7/h1-4H,(H2,7,8);(H,6,7)
InChI Key:
STBDXCULUSZTMT-UHFFFAOYSA-N
SMILES:
OC(=O)C(F)(F)F.O=Cc1c[nH]ccc1=N
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.041g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.15g/mol
Monoisotopic Mass:
236.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
93.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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