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1439902-46-1

1439902-46-1 | 4-Bromo-2-cyclopropylisoindolin-1-one

CAS No: 1439902-46-1 Catalog No: AG01FD40 MDL No:

Product Description

Catalog Number:
AG01FD40
Chemical Name:
4-Bromo-2-cyclopropylisoindolin-1-one
CAS Number:
1439902-46-1
Molecular Formula:
C11H10BrNO
Molecular Weight:
252.1072
IUPAC Name:
4-bromo-2-cyclopropyl-3H-isoindol-1-one
InChI:
InChI=1S/C11H10BrNO/c12-10-3-1-2-8-9(10)6-13(11(8)14)7-4-5-7/h1-3,7H,4-6H2
InChI Key:
VIMYEVIPXVVLIH-UHFFFAOYSA-N
SMILES:
Brc1cccc2c1CN(C2=O)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  

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