sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys 3-Bromo-5-methoxyindole-1-carboxylic acid tert-butyl ester

3-Bromo-5-methoxyindole-1-carboxylic acid tert-butyl ester

CAS No.:
348640-11-9
Catalog Number:
AG00C7IX
Molecular Formula:
C14H16BrNO3
Molecular Weight:
326.1857
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$150
- +
10g
98%
In Stock USA
United States
$225
- +
25g
98%
In Stock USA
United States
$494
- +
Product Description
Catalog Number:
AG00C7IX
Chemical Name:
3-Bromo-5-methoxyindole-1-carboxylic acid tert-butyl ester
CAS Number:
348640-11-9
Molecular Formula:
C14H16BrNO3
Molecular Weight:
326.1857
MDL Number:
MFCD05864762
IUPAC Name:
tert-butyl 3-bromo-5-methoxyindole-1-carboxylate
InChI:
InChI=1S/C14H16BrNO3/c1-14(2,3)19-13(17)16-8-11(15)10-7-9(18-4)5-6-12(10)16/h5-8H,1-4H3
InChI Key:
DCTZDUWRIAYEIF-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(Br)cn2C(=O)OC(C)(C)C
Properties
Complexity:
342  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.031g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.19g/mol
Monoisotopic Mass:
325.031g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties