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Home > Imidazoles > 1803565-72-1
1803565-72-1 | 5-{[1-(2-methoxyethyl)-1H-1,2,3-triazol-4-yl]methyl}imidazolidine-2,4-dione
CAS No: 1803565-72-1 Catalog No: AG01AGB6 MDL No:MFCD28118203
Product Description
Catalog Number:
AG01AGB6
Chemical Name:
5-{[1-(2-methoxyethyl)-1H-1,2,3-triazol-4-yl]methyl}imidazolidine-2,4-dione
CAS Number:
1803565-72-1
Molecular Formula:
C9H13N5O3
Molecular Weight:
239.2312
MDL Number:
MFCD28118203
IUPAC Name:
5-[[1-(2-methoxyethyl)triazol-4-yl]methyl]imidazolidine-2,4-dione
InChI:
InChI=1S/C9H13N5O3/c1-17-3-2-14-5-6(12-13-14)4-7-8(15)11-9(16)10-7/h5,7H,2-4H2,1H3,(H2,10,11,15,16)
InChI Key:
APLRPUZVZJFSGN-UHFFFAOYSA-N
SMILES:
COCCn1cc(nn1)CC1NC(=O)NC1=O
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.102g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.235g/mol
Monoisotopic Mass:
239.102g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
98.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5
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