Home Halogens 4-Amino-3-bromo-benzoic acid ethyl ester

4-Amino-3-bromo-benzoic acid ethyl ester

CAS No.:
7149-03-3
Catalog Number:
AG003Q9P
Molecular Formula:
C9H10BrNO2
Molecular Weight:
244.0852
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>95%
In Stock USA
United States
$141
- +
10g
>95%
In Stock USA
United States
$203
- +
Product Description
Catalog Number:
AG003Q9P
Chemical Name:
4-Amino-3-bromo-benzoic acid ethyl ester
CAS Number:
7149-03-3
Molecular Formula:
C9H10BrNO2
Molecular Weight:
244.0852
MDL Number:
MFCD03407825
IUPAC Name:
ethyl 4-amino-3-bromobenzoate
InChI:
InChI=1S/C9H10BrNO2/c1-2-13-9(12)6-3-4-8(11)7(10)5-6/h3-5H,2,11H2,1H3
InChI Key:
NOGUJGZZMMKQOZ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(c(c1)Br)N
NSC Number:
51689
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.989g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
244.088g/mol
Monoisotopic Mass:
242.989g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties