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89849-54-7 | 5-Hexen-2-one, 6-phenyl-, oxime, (Z,E)-
CAS No: 89849-54-7 Catalog No: AG003XG8 MDL No:
Product Description
Catalog Number:
AG003XG8
Chemical Name:
5-Hexen-2-one, 6-phenyl-, oxime, (Z,E)-
CAS Number:
89849-54-7
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
IUPAC Name:
N-(6-phenylhex-5-en-2-ylidene)hydroxylamine
InChI:
InChI=1S/C12H15NO/c1-11(13-14)7-5-6-10-12-8-3-2-4-9-12/h2-4,6,8-10,14H,5,7H2,1H3
InChI Key:
HUDFEMBUIDSYNZ-UHFFFAOYSA-N
SMILES:
O/N=C(/CC/C=C\c1ccccc1)\C
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
2.7
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