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1185303-12-1 | 4-(5-Methyl-furan-2-yl)-phenylamineoxalate
CAS No: 1185303-12-1 Catalog No: AG01FO4H MDL No:
Product Description
Catalog Number:
AG01FO4H
Chemical Name:
4-(5-Methyl-furan-2-yl)-phenylamineoxalate
CAS Number:
1185303-12-1
IUPAC Name:
4-(5-methylfuran-2-yl)aniline;oxalic acid
InChI:
InChI=1S/C11H11NO.C2H2O4/c1-8-2-7-11(13-8)9-3-5-10(12)6-4-9;3-1(4)2(5)6/h2-7H,12H2,1H3;(H,3,4)(H,5,6)
InChI Key:
QLMOYUZXZTZLGP-UHFFFAOYSA-N
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.079g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
263.249g/mol
Monoisotopic Mass:
263.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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