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143996-88-7 | 2,3-Pentanedione, 4-(propylimino)-, 3-oxime
CAS No: 143996-88-7 Catalog No: AG001IQH MDL No:
Product Description
Catalog Number:
AG001IQH
Chemical Name:
2,3-Pentanedione, 4-(propylimino)-, 3-oxime
CAS Number:
143996-88-7
Molecular Formula:
C8H14N2O2
Molecular Weight:
170.2090
IUPAC Name:
3-hydroxyimino-4-propyliminopentan-2-one
InChI:
InChI=1S/C8H14N2O2/c1-4-5-9-6(2)8(10-12)7(3)11/h12H,4-5H2,1-3H3
InChI Key:
UNDSOBIYFOSINK-UHFFFAOYSA-N
SMILES:
CCCN=C(C(=NO)C(=O)C)C
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.106g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.212g/mol
Monoisotopic Mass:
170.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.3
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