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Home > Aldehydes > 142730-53-8
142730-53-8 | 8-Methyl-10-oxo-2,3,5,6-tetrahydro-1H,4H,10H -11-oxa-3a-aza-benzo[de]anthracene-9-carbaldehyde
CAS No: 142730-53-8 Catalog No: AG01F291 MDL No:
Product Description
Catalog Number:
AG01F291
Chemical Name:
8-Methyl-10-oxo-2,3,5,6-tetrahydro-1H,4H,10H -11-oxa-3a-aza-benzo[de]anthracene-9-carbaldehyde
CAS Number:
142730-53-8
Molecular Formula:
C17H17NO3
Molecular Weight:
283.3218
IUPAC Name:
6-methyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),5,8-tetraene-5-carbaldehyde
InChI:
InChI=1S/C17H17NO3/c1-10-13-8-11-4-2-6-18-7-3-5-12(15(11)18)16(13)21-17(20)14(10)9-19/h8-9H,2-7H2,1H3
InChI Key:
ZBZZGJPDANZGGV-UHFFFAOYSA-N
SMILES:
O=Cc1c(=O)oc2c(c1C)cc1c3c2CCCN3CCC1
Properties
Complexity:
512
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.121g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.327g/mol
Monoisotopic Mass:
283.121g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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