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174349-93-0

174349-93-0 | 2H-Inden-2-one, 5-bromo-1,3-dihydro-

CAS No: 174349-93-0 Catalog No: AG001ZLN MDL No:MFCD07778391

Product Description

Catalog Number:
AG001ZLN
Chemical Name:
2H-Inden-2-one, 5-bromo-1,3-dihydro-
CAS Number:
174349-93-0
Molecular Formula:
C9H7BrO
Molecular Weight:
211.0553
MDL Number:
MFCD07778391
IUPAC Name:
5-bromo-1,3-dihydroinden-2-one
InChI:
InChI=1S/C9H7BrO/c10-8-2-1-6-4-9(11)5-7(6)3-8/h1-3H,4-5H2
InChI Key:
JQBSSMBLVVTRKJ-UHFFFAOYSA-N
SMILES:
O=C1Cc2c(C1)cc(cc2)Br

Properties

Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.968g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.058g/mol
Monoisotopic Mass:
209.968g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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