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226987-23-1 | 1H-Pyrrolo[2,1-c][1,4]oxazocine(9CI)
CAS No: 226987-23-1 Catalog No: AG00BTWY MDL No:
Product Description
Catalog Number:
AG00BTWY
Chemical Name:
1H-Pyrrolo[2,1-c][1,4]oxazocine(9CI)
CAS Number:
226987-23-1
IUPAC Name:
1H-pyrrolo[2,1-c][1,4]oxazocine
InChI:
InChI=1S/C9H9NO/c1-2-7-11-8-9-4-3-6-10(9)5-1/h1-7H,8H2
InChI Key:
FRODVHSZRIGYAM-UHFFFAOYSA-N
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
14.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
1.3
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