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186418-49-5 | 5H-Pyrrolo[2',3':4,5]pyrrolo[1,2-c]oxazole(9CI)
CAS No: 186418-49-5 Catalog No: AG007SAP MDL No:
Product Description
Catalog Number:
AG007SAP
Chemical Name:
5H-Pyrrolo[2',3':4,5]pyrrolo[1,2-c]oxazole(9CI)
CAS Number:
186418-49-5
Molecular Formula:
C8H6N2O
Molecular Weight:
146.1460
IUPAC Name:
10-oxa-1,5-diazatricyclo[6.3.0.02,6]undeca-2,4,6,8-tetraene
InChI:
InChI=1S/C8H6N2O/c1-2-9-7-3-6-4-11-5-10(6)8(1)7/h1-4H,5H2
InChI Key:
FNLWWELTGYGREC-UHFFFAOYSA-N
SMILES:
C1=Nc2c(=C1)n1c(=COC1)c2
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.048g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.149g/mol
Monoisotopic Mass:
146.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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