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20933-24-8 | 1(2H)-Naphthalenone, 2-bromo-3,4-dihydro-6-methoxy-
CAS No: 20933-24-8 Catalog No: AG002K78 MDL No:MFCD09056778
Product Description
Catalog Number:
AG002K78
Chemical Name:
1(2H)-Naphthalenone, 2-bromo-3,4-dihydro-6-methoxy-
CAS Number:
20933-24-8
Molecular Formula:
C11H11BrO2
Molecular Weight:
255.1078
MDL Number:
MFCD09056778
IUPAC Name:
2-bromo-6-methoxy-3,4-dihydro-2H-naphthalen-1-one
InChI:
InChI=1S/C11H11BrO2/c1-14-8-3-4-9-7(6-8)2-5-10(12)11(9)13/h3-4,6,10H,2,5H2,1H3
InChI Key:
NAXVBXDTOCUKNH-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)CCC(C2=O)Br
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.994g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.111g/mol
Monoisotopic Mass:
253.994g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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