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132095-53-5 | 2(1H)-Naphthalenone, 5-bromo-3,4-dihydro-
CAS No: 132095-53-5 Catalog No: AG00106Q MDL No:MFCD04038485
Product Description
Catalog Number:
AG00106Q
Chemical Name:
2(1H)-Naphthalenone, 5-bromo-3,4-dihydro-
CAS Number:
132095-53-5
Molecular Formula:
C10H9BrO
Molecular Weight:
225.0819
MDL Number:
MFCD04038485
IUPAC Name:
5-bromo-3,4-dihydro-1H-naphthalen-2-one
InChI:
InChI=1S/C10H9BrO/c11-10-3-1-2-7-6-8(12)4-5-9(7)10/h1-3H,4-6H2
InChI Key:
DDVQSZNNPLLKCW-UHFFFAOYSA-N
SMILES:
O=C1CCc2c(C1)cccc2Br
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.984g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.085g/mol
Monoisotopic Mass:
223.984g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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