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88989-44-0

88989-44-0 | [1]Benzopyrano[4,3-b]pyrrole, 3,3a,4,9b-tetrahydro-2-phenyl-, cis-

CAS No: 88989-44-0 Catalog No: AG0045GI MDL No:

Product Description

Catalog Number:
AG0045GI
Chemical Name:
[1]Benzopyrano[4,3-b]pyrrole, 3,3a,4,9b-tetrahydro-2-phenyl-, cis-
CAS Number:
88989-44-0
Molecular Formula:
C17H15NO
Molecular Weight:
249.3071
IUPAC Name:
2-phenyl-3,3a,4,9b-tetrahydrochromeno[4,3-b]pyrrole
InChI:
InChI=1S/C17H15NO/c1-2-6-12(7-3-1)15-10-13-11-19-16-9-5-4-8-14(16)17(13)18-15/h1-9,13,17H,10-11H2
InChI Key:
GRFVFLYBHMKISL-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1=N[C@@H]2[C@H](C1)COc1c2cccc1

Properties

Complexity:
358  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.115g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.313g/mol
Monoisotopic Mass:
249.115g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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