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88897-76-1 | 7(1H)-Indolizinone, 2-(4-fluorophenyl)hexahydro-, oxime, trans-
CAS No: 88897-76-1 Catalog No: AG0049EL MDL No:
Product Description
Catalog Number:
AG0049EL
Chemical Name:
7(1H)-Indolizinone, 2-(4-fluorophenyl)hexahydro-, oxime, trans-
CAS Number:
88897-76-1
Molecular Formula:
C14H17FN2O
Molecular Weight:
248.2960
IUPAC Name:
N-[2-(4-fluorophenyl)-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-ylidene]hydroxylamine
InChI:
InChI=1S/C14H17FN2O/c15-12-3-1-10(2-4-12)11-7-14-8-13(16-18)5-6-17(14)9-11/h1-4,11,14,18H,5-9H2
InChI Key:
VVHUGBSDYPNHLW-UHFFFAOYSA-N
SMILES:
ON=C1CCN2[C@@H](C1)C[C@H](C2)c1ccc(cc1)F
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.132g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.301g/mol
Monoisotopic Mass:
248.132g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
2
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