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142184-78-9 | CIS-QUINOLINE-5,6,7,8-DIOXIDE
CAS No: 142184-78-9 Catalog No: AG00AEE5 MDL No:
Product Description
Catalog Number:
AG00AEE5
Chemical Name:
CIS-QUINOLINE-5,6,7,8-DIOXIDE
CAS Number:
142184-78-9
IUPAC Name:
(2S,4S)-3,6-dioxa-9-azatetracyclo[6.4.0.02,4.05,7]dodeca-1(8),9,11-triene
InChI:
InChI=1S/C9H7NO2/c1-2-4-5(10-3-1)7-9(12-7)8-6(4)11-8/h1-3,6-9H/t6-,7?,8-,9?/m0/s1
InChI Key:
DLTXKFCMJDWKEV-KJMVCIMSSA-N
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
161.048g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.16g/mol
Monoisotopic Mass:
161.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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