sales@angenesci.com
Login | Register
logo
Structures Search
Home Halogens tert-Butyl-4-bromoisoindoline-2-carboxylate

tert-Butyl-4-bromoisoindoline-2-carboxylate

CAS No.:
1035235-27-8
Catalog Number:
AG007XED
Molecular Formula:
C13H16BrNO2
Molecular Weight:
298.1756
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
25g
98%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG007XED
Chemical Name:
tert-Butyl-4-bromoisoindoline-2-carboxylate
CAS Number:
1035235-27-8
Molecular Formula:
C13H16BrNO2
Molecular Weight:
298.1756
MDL Number:
MFCD10700130
IUPAC Name:
tert-butyl 4-bromo-1,3-dihydroisoindole-2-carboxylate
InChI:
InChI=1S/C13H16BrNO2/c1-13(2,3)17-12(16)15-7-9-5-4-6-11(14)10(9)8-15/h4-6H,7-8H2,1-3H3
InChI Key:
BFCZVUVSPUKWET-UHFFFAOYSA-N
SMILES:
O=C(N1Cc2c(C1)cccc2Br)OC(C)(C)C
Properties
Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.036g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.18g/mol
Monoisotopic Mass:
297.036g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties