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648880-46-0 | Imidazolidine, 1-(3-furanylmethyl)-2-(nitromethylene)-
CAS No: 648880-46-0 Catalog No: AG006S8L MDL No:
Product Description
Catalog Number:
AG006S8L
Chemical Name:
Imidazolidine, 1-(3-furanylmethyl)-2-(nitromethylene)-
CAS Number:
648880-46-0
Molecular Formula:
C9H11N3O3
Molecular Weight:
209.2019
IUPAC Name:
1-(furan-3-ylmethyl)-2-(nitromethylidene)imidazolidine
InChI:
InChI=1S/C9H11N3O3/c13-12(14)6-9-10-2-3-11(9)5-8-1-4-15-7-8/h1,4,6-7,10H,2-3,5H2
InChI Key:
BSOQIOUYWGEUBE-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C=C1NCCN1Cc1cocc1
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.08g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.205g/mol
Monoisotopic Mass:
209.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1
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