Home Halogens 1-amino-4-bromonaphthalene-2-carboxylic acid

1-amino-4-bromonaphthalene-2-carboxylic acid

CAS No.:
1227924-42-6
Catalog Number:
AG01B6RQ
Molecular Formula:
C11H8BrNO2
Molecular Weight:
266.0907
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Product Description
Catalog Number:
AG01B6RQ
Chemical Name:
1-amino-4-bromonaphthalene-2-carboxylic acid
CAS Number:
1227924-42-6
Molecular Formula:
C11H8BrNO2
Molecular Weight:
266.0907
MDL Number:
MFCD22571332
IUPAC Name:
1-amino-4-bromonaphthalene-2-carboxylic acid
InChI:
InChI=1S/C11H8BrNO2/c12-9-5-8(11(14)15)10(13)7-4-2-1-3-6(7)9/h1-5H,13H2,(H,14,15)
InChI Key:
NWPPYQDIGHSGNJ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(Br)c2c(c1N)cccc2
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.974g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
266.094g/mol
Monoisotopic Mass:
264.974g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties