Home Halogens 5-Bromo-6-chloro-3-indolyl caprylate

5-Bromo-6-chloro-3-indolyl caprylate

CAS No.:
209347-94-4
Catalog Number:
AG002K6Q
Molecular Formula:
C16H19BrClNO2
Molecular Weight:
372.6846
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥ 98% (TLC)
1 week
United States
$126
- +
1g
≥ 98% (TLC)
1 week
United States
$243
- +
5g
≥ 98% (TLC)
1 week
United States
$901
- +
Product Description
Catalog Number:
AG002K6Q
Chemical Name:
5-Bromo-6-chloro-3-indolyl caprylate
CAS Number:
209347-94-4
Molecular Formula:
C16H19BrClNO2
Molecular Weight:
372.6846
MDL Number:
MFCD00798386
IUPAC Name:
(5-bromo-6-chloro-1H-indol-3-yl) octanoate
InChI:
InChI=1S/C16H19BrClNO2/c1-2-3-4-5-6-7-16(20)21-15-10-19-14-9-13(18)12(17)8-11(14)15/h8-10,19H,2-7H2,1H3
InChI Key:
HODNRFUPDHGKHG-UHFFFAOYSA-N
SMILES:
CCCCCCCC(=O)Oc1c[nH]c2c1cc(Br)c(c2)Cl
Properties
Complexity:
342  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
371.029g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
372.687g/mol
Monoisotopic Mass:
371.029g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1  
Properties