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Home > Aldehydes > 134516-26-0
134516-26-0 | 1H-Pyrazole-4-carboxaldehyde,1-ethyl-,oxime(9CI)
CAS No: 134516-26-0 Catalog No: AG00AHO4 MDL No:MFCD18834153
Product Description
Catalog Number:
AG00AHO4
Chemical Name:
1H-Pyrazole-4-carboxaldehyde,1-ethyl-,oxime(9CI)
CAS Number:
134516-26-0
Molecular Formula:
C6H9N3O
Molecular Weight:
139.1552
MDL Number:
MFCD18834153
IUPAC Name:
(NE)-N-[(1-ethylpyrazol-4-yl)methylidene]hydroxylamine
InChI:
InChI=1S/C6H9N3O/c1-2-9-5-6(3-7-9)4-8-10/h3-5,10H,2H2,1H3/b8-4+
InChI Key:
TZYXIQGWFWZRGJ-XBXARRHUSA-N
SMILES:
O/N=C\c1cnn(c1)CC
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
139.075g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.158g/mol
Monoisotopic Mass:
139.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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