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53525-65-8 | 5H,10H-DIIMIDAZO[1,5-A
CAS No: 53525-65-8 Catalog No: AG00D93L MDL No:MFCD10699721
Product Description
Catalog Number:
AG00D93L
Chemical Name:
5H,10H-DIIMIDAZO[1,5-A
CAS Number:
53525-65-8
Molecular Formula:
C8H4N4O2
Molecular Weight:
188.1430
MDL Number:
MFCD10699721
IUPAC Name:
1,5,7,11-tetrazatricyclo[7.3.0.03,7]dodeca-3,5,9,11-tetraene-2,8-dione
InChI:
InChI=1S/C8H4N4O2/c13-7-5-1-9-3-11(5)8(14)6-2-10-4-12(6)7/h1-4H
InChI Key:
UYAAVKFHBMJOJZ-UHFFFAOYSA-N
SMILES:
O=c1c2cncn2c(=O)c2n1cnc2
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.033g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.146g/mol
Monoisotopic Mass:
188.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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