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418757-90-1 | 2H-Pyrrolo[1,2,3-cd]benzoxazole(9CI)
CAS No: 418757-90-1 Catalog No: AG00CY1V MDL No:
Product Description
Catalog Number:
AG00CY1V
Chemical Name:
2H-Pyrrolo[1,2,3-cd]benzoxazole(9CI)
CAS Number:
418757-90-1
IUPAC Name:
2-oxa-4-azatricyclo[5.3.1.04,11]undeca-1(10),5,7(11),8-tetraene
InChI:
InChI=1S/C9H7NO/c1-2-7-4-5-10-6-11-8(3-1)9(7)10/h1-5H,6H2
InChI Key:
GKWHQMBBHBYRKC-UHFFFAOYSA-N
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.053g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.161g/mol
Monoisotopic Mass:
145.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
14.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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