sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 6-Bromo-2-naphthoic acid

6-Bromo-2-naphthoic acid

CAS No.:
5773-80-8
Catalog Number:
AG0034C5
Molecular Formula:
C11H7BrO2
Molecular Weight:
251.0761
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$62
- +
100g
98%
In Stock USA
United States
$188
- +
500g
98%
In Stock USA
United States
$788
- +
Product Description
Catalog Number:
AG0034C5
Chemical Name:
6-Bromo-2-naphthoic acid
CAS Number:
5773-80-8
Molecular Formula:
C11H7BrO2
Molecular Weight:
251.0761
MDL Number:
MFCD01075720
IUPAC Name:
6-bromonaphthalene-2-carboxylic acid
InChI:
InChI=1S/C11H7BrO2/c12-10-4-3-7-5-9(11(13)14)2-1-8(7)6-10/h1-6H,(H,13,14)
InChI Key:
NPMCAVBMOTZUPD-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)ccc(c2)C(=O)O
EC Number:
611-572-1
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.963g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
251.079g/mol
Monoisotopic Mass:
249.963g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Literature
Title Journal
New synthesis of 6[3-(1-adamantyl)-4-methoxyphenyl]-2-naphthoic acid and evaluation of the influence of adamantyl group on the DNA binding of a naphthoic retinoid. Bioorganic chemistry 20110801
Structures and vibrational frequencies of 2-naphthoic acid and 6-bromo-2-naphthoic acid based on density functional theory calculations. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20080601
Properties