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1263279-55-5 | Spiro[cyclopropane-1,3'-[3H]pyrrolo[2,3-b]pyridin]-2'(1'H)-one, 5'-bromo-
CAS No: 1263279-55-5 Catalog No: AG000SL8 MDL No:MFCD22422694
Product Description
Catalog Number:
AG000SL8
Chemical Name:
Spiro[cyclopropane-1,3'-[3H]pyrrolo[2,3-b]pyridin]-2'(1'H)-one, 5'-bromo-
CAS Number:
1263279-55-5
Molecular Formula:
C9H7BrN2O
Molecular Weight:
239.0687
MDL Number:
MFCD22422694
IUPAC Name:
5-bromospiro[1H-pyrrolo[2,3-b]pyridine-3,1'-cyclopropane]-2-one
InChI:
InChI=1S/C9H7BrN2O/c10-5-3-6-7(11-4-5)12-8(13)9(6)1-2-9/h3-4H,1-2H2,(H,11,12,13)
InChI Key:
XECQXIMRMBPQQE-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C31CC3)cc(cn2)Br
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.974g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.072g/mol
Monoisotopic Mass:
237.974g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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