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Home > Aldehydes > 138023-46-8
138023-46-8 | 1,4-Ethanoquinoxaline-5-carboxaldehyde, 2,3-dihydro- (9CI)
CAS No: 138023-46-8 Catalog No: AG0017UF MDL No:
Product Description
Catalog Number:
AG0017UF
Chemical Name:
1,4-Ethanoquinoxaline-5-carboxaldehyde, 2,3-dihydro- (9CI)
CAS Number:
138023-46-8
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
IUPAC Name:
1,8-diazatricyclo[6.2.2.02,7]dodeca-2,4,6-triene-3-carbaldehyde
InChI:
InChI=1S/C11H12N2O/c14-8-9-2-1-3-10-11(9)13-6-4-12(10)5-7-13/h1-3,8H,4-7H2
InChI Key:
XTLHUIAHKGMMGB-UHFFFAOYSA-N
SMILES:
O=Cc1cccc2c1N1CCN2CC1
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.23g/mol
Monoisotopic Mass:
188.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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