Home Other Building Blocks 6-Bromo-2-cyclopropylisoindolin-1-one

6-Bromo-2-cyclopropylisoindolin-1-one

CAS No.:
1245649-56-2
Catalog Number:
AG01CAF7
Molecular Formula:
C11H10BrNO
Molecular Weight:
252.1072
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Product Description
Catalog Number:
AG01CAF7
Chemical Name:
6-Bromo-2-cyclopropylisoindolin-1-one
CAS Number:
1245649-56-2
Molecular Formula:
C11H10BrNO
Molecular Weight:
252.1072
MDL Number:
MFCD18072653
IUPAC Name:
6-bromo-2-cyclopropyl-3H-isoindol-1-one
InChI:
InChI=1S/C11H10BrNO/c12-8-2-1-7-6-13(9-3-4-9)11(14)10(7)5-8/h1-2,5,9H,3-4,6H2
InChI Key:
NEJCKAFHTYFEGR-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)C(=O)N(C2)C1CC1
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.995g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.111g/mol
Monoisotopic Mass:
250.995g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties