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1935598-60-9 | 2-(1-methyl-1H-imidazol-2-yl)oxane-3-carbaldehyde
CAS No: 1935598-60-9 Catalog No: AG01C7RP MDL No:MFCD31439667
Product Description
Catalog Number:
AG01C7RP
Chemical Name:
2-(1-methyl-1H-imidazol-2-yl)oxane-3-carbaldehyde
CAS Number:
1935598-60-9
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
MDL Number:
MFCD31439667
IUPAC Name:
2-(1-methylimidazol-2-yl)oxane-3-carbaldehyde
InChI:
InChI=1S/C10H14N2O2/c1-12-5-4-11-10(12)9-8(7-13)3-2-6-14-9/h4-5,7-9H,2-3,6H2,1H3
InChI Key:
KMLMEDCAUOPOGL-UHFFFAOYSA-N
SMILES:
O=CC1CCCOC1c1nccn1C
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.234g/mol
Monoisotopic Mass:
194.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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