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82589-57-9 | 2,4-imidazolidinedione, 5-(2-hydroxyphenyl)-
CAS No: 82589-57-9 Catalog No: AG004XN0 MDL No:MFCD20727918
Product Description
Catalog Number:
AG004XN0
Chemical Name:
2,4-imidazolidinedione, 5-(2-hydroxyphenyl)-
CAS Number:
82589-57-9
Molecular Formula:
C9H8N2O3
Molecular Weight:
192.1714
MDL Number:
MFCD20727918
IUPAC Name:
3-methoxy-7,9,10,11,11a,12-hexahydronaphtho[2,1-f]indolizine
InChI:
InChI=1S/C17H19NO/c1-19-15-6-7-16-12(9-15)4-5-13-11-18-8-2-3-14(18)10-17(13)16/h4-7,9,14H,2-3,8,10-11H2,1H3
InChI Key:
VBQFEZHKFJNYJB-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(N1)c1ccccc1O
NSC Number:
321154
Properties
Complexity:
331
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:
0
Isotope Atom Count:
0
Molecular Weight:
253.345g/mol
Monoisotopic Mass:
253.147g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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