Home Carboxys t-Butyl 1,3-dihydroisoindole-2-carboxylate

t-Butyl 1,3-dihydroisoindole-2-carboxylate

CAS No.:
260412-75-7
Catalog Number:
AG002RGZ
Molecular Formula:
C13H17NO2
Molecular Weight:
219.2796
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$225
- +
5g
98%
In Stock USA
United States
$675
- +
Product Description
Catalog Number:
AG002RGZ
Chemical Name:
t-Butyl 1,3-dihydroisoindole-2-carboxylate
CAS Number:
260412-75-7
Molecular Formula:
C13H17NO2
Molecular Weight:
219.2796
MDL Number:
MFCD21106377
IUPAC Name:
tert-butyl 1,3-dihydroisoindole-2-carboxylate
InChI:
InChI=1S/C13H17NO2/c1-13(2,3)16-12(15)14-8-10-6-4-5-7-11(10)9-14/h4-7H,8-9H2,1-3H3
InChI Key:
DXECVLLAHDLREE-UHFFFAOYSA-N
SMILES:
O=C(N1Cc2c(C1)cccc2)OC(C)(C)C
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.126g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.284g/mol
Monoisotopic Mass:
219.126g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties