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Home > Bromides > 1330763-93-3
1330763-93-3 | 1H-Isoindol-1-one, 7-bromo-2,3-dihydro-2-methyl-
CAS No: 1330763-93-3 Catalog No: AG001477 MDL No:MFCD18205412
Product Description
Catalog Number:
AG001477
Chemical Name:
1H-Isoindol-1-one, 7-bromo-2,3-dihydro-2-methyl-
CAS Number:
1330763-93-3
Molecular Formula:
C9H8BrNO
Molecular Weight:
226.0699
MDL Number:
MFCD18205412
IUPAC Name:
7-bromo-2-methyl-3H-isoindol-1-one
InChI:
InChI=1S/C9H8BrNO/c1-11-5-6-3-2-4-7(10)8(6)9(11)12/h2-4H,5H2,1H3
InChI Key:
XVELRSQAHQYTRK-UHFFFAOYSA-N
SMILES:
CN1Cc2c(C1=O)c(Br)ccc2
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.979g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.073g/mol
Monoisotopic Mass:
224.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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