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10045-64-4 | 1H-Imidazole-2-carboxaldehyde, 1-(phenylmethyl)-, oxime
CAS No: 10045-64-4 Catalog No: AG000212 MDL No:
Product Description
Catalog Number:
AG000212
Chemical Name:
1H-Imidazole-2-carboxaldehyde, 1-(phenylmethyl)-, oxime
CAS Number:
10045-64-4
Molecular Formula:
C11H11N3O
Molecular Weight:
201.2245
IUPAC Name:
(NE)-N-[(1-benzylimidazol-2-yl)methylidene]hydroxylamine
InChI:
InChI=1S/C11H11N3O/c15-13-8-11-12-6-7-14(11)9-10-4-2-1-3-5-10/h1-8,15H,9H2/b13-8+
InChI Key:
ZURFKEMTJOYRFN-MDWZMJQESA-N
SMILES:
ON=Cc1nccn1Cc1ccccc1
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
201.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.229g/mol
Monoisotopic Mass:
201.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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