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14197-51-4 | 2(3H)-Furanone, dihydro-3-[1-(phenylamino)ethylidene]-
CAS No: 14197-51-4 Catalog No: AG001HHF MDL No:
Product Description
Catalog Number:
AG001HHF
Chemical Name:
2(3H)-Furanone, dihydro-3-[1-(phenylamino)ethylidene]-
CAS Number:
14197-51-4
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
IUPAC Name:
3-(1-anilinoethylidene)oxolan-2-one
InChI:
InChI=1S/C12H13NO2/c1-9(11-7-8-15-12(11)14)13-10-5-3-2-4-6-10/h2-6,13H,7-8H2,1H3
InChI Key:
RWAIILIXTWTSAD-UHFFFAOYSA-N
SMILES:
CC(=C1CCOC1=O)Nc1ccccc1
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.241g/mol
Monoisotopic Mass:
203.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.3
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