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157701-33-2 | Acetamide, N-(6-bromo-2,3-dihydro-1H-inden-5-yl)-
CAS No: 157701-33-2 Catalog No: AG001PMX MDL No:MFCD09263981
Product Description
Catalog Number:
AG001PMX
Chemical Name:
Acetamide, N-(6-bromo-2,3-dihydro-1H-inden-5-yl)-
CAS Number:
157701-33-2
Molecular Formula:
C11H12BrNO
Molecular Weight:
254.1231
MDL Number:
MFCD09263981
IUPAC Name:
N-(6-bromo-2,3-dihydro-1H-inden-5-yl)acetamide
InChI:
InChI=1S/C11H12BrNO/c1-7(14)13-11-6-9-4-2-3-8(9)5-10(11)12/h5-6H,2-4H2,1H3,(H,13,14)
InChI Key:
BSZWXNUSLPNWEZ-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc2CCCc2cc1Br
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.01g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.127g/mol
Monoisotopic Mass:
253.01g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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