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Home > Other Heterocycles > 113942-18-0
113942-18-0 | Bicyclo[2.2.1]hept-5-en-2-one, 7-[(4-propylphenyl)methylene]-, oxime
CAS No: 113942-18-0 Catalog No: AG000A4K MDL No:
Product Description
Catalog Number:
AG000A4K
Chemical Name:
Bicyclo[2.2.1]hept-5-en-2-one, 7-[(4-propylphenyl)methylene]-, oxime
CAS Number:
113942-18-0
Molecular Formula:
C17H19NO
Molecular Weight:
253.3389
IUPAC Name:
N-[7-[(4-propylphenyl)methylidene]-2-bicyclo[2.2.1]hept-5-enylidene]hydroxylamine
InChI:
InChI=1S/C17H19NO/c1-2-3-12-4-6-13(7-5-12)10-16-14-8-9-15(16)17(11-14)18-19/h4-10,14-15,19H,2-3,11H2,1H3
InChI Key:
WRASSEAZVWUFIV-UHFFFAOYSA-N
SMILES:
CCCc1ccc(cc1)C=C1C2C=CC1C(=NO)C2
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.345g/mol
Monoisotopic Mass:
253.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
2
XLogP3:
3.9
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