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131331-19-6 | 2-Naphthalenecarboxylic acid, 6,7-dibromo-
CAS No: 131331-19-6 Catalog No: AG000VYN MDL No:MFCD23701689
Product Description
Catalog Number:
AG000VYN
Chemical Name:
2-Naphthalenecarboxylic acid, 6,7-dibromo-
CAS Number:
131331-19-6
Molecular Formula:
C11H6Br2O2
Molecular Weight:
329.9721
MDL Number:
MFCD23701689
IUPAC Name:
6,7-dibromonaphthalene-2-carboxylic acid
InChI:
InChI=1S/C11H6Br2O2/c12-9-4-6-1-2-7(11(14)15)3-8(6)5-10(9)13/h1-5H,(H,14,15)
InChI Key:
QZUXMZSECRBNNF-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)cc(c(c2)Br)Br
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.871g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
329.975g/mol
Monoisotopic Mass:
327.873g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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