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Home > Bromides > 1779133-17-3
1779133-17-3 | 7-Bromo-2-cyclopropylisoindolin-1-one
CAS No: 1779133-17-3 Catalog No: AG01FD8H MDL No:
Product Description
Catalog Number:
AG01FD8H
Chemical Name:
7-Bromo-2-cyclopropylisoindolin-1-one
CAS Number:
1779133-17-3
Molecular Formula:
C11H10BrNO
Molecular Weight:
252.1072
IUPAC Name:
7-bromo-2-cyclopropyl-3H-isoindol-1-one
InChI:
InChI=1S/C11H10BrNO/c12-9-3-1-2-7-6-13(8-4-5-8)11(14)10(7)9/h1-3,8H,4-6H2
InChI Key:
IANBGNXEFRQVOM-UHFFFAOYSA-N
SMILES:
Brc1cccc2c1C(=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
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