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Home > Aldehydes > 1076198-20-3
1076198-20-3 | 1,7-DibroMo-4a,5,9,10-tetrahydro-2-Methoxy-6-oxo-6H-benzofuro[3a,3,2-ef][2]benzazepine-11(12H)-carboxaldehyde
CAS No: 1076198-20-3 Catalog No: AG008WDX MDL No:
Product Description
Catalog Number:
AG008WDX
Chemical Name:
1,7-DibroMo-4a,5,9,10-tetrahydro-2-Methoxy-6-oxo-6H-benzofuro[3a,3,2-ef][2]benzazepine-11(12H)-carboxaldehyde
CAS Number:
1076198-20-3
IUPAC Name:
(1S)-7,15-dibromo-8-methoxy-14-oxo-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraene-4-carbaldehyde
InChI:
InChI=1S/C17H15Br2NO4/c1-23-13-5-12-15-9(16(13)19)7-20(8-21)3-2-17(15)6-10(18)11(22)4-14(17)24-12/h5-6,8,14H,2-4,7H2,1H3/t14?,17-/m1/s1
InChI Key:
BMAIEDSRZQHEEY-FBMWCMRBSA-N
Properties
Complexity:
597
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
456.935g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
457.118g/mol
Monoisotopic Mass:
454.937g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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