Home Carboxys 6,7-Diethoxy-3,4-dihydro-1h-isoquinoline-1,2-dicarboxylic acid 2-tert-butyl ester

6,7-Diethoxy-3,4-dihydro-1h-isoquinoline-1,2-dicarboxylic acid 2-tert-butyl ester

CAS No.:
1214645-14-3
Catalog Number:
AG0014ZS
Molecular Formula:
C19H26NO6-
Molecular Weight:
364.4128
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
In Stock USA
United States
$123
- +
500mg
In Stock USA
United States
$221
- +
1g
In Stock USA
United States
$401
- +
2.5g
In Stock USA
United States
$880
- +
5g
In Stock USA
United States
$1623
- +
Product Description
Catalog Number:
AG0014ZS
Chemical Name:
6,7-Diethoxy-3,4-dihydro-1h-isoquinoline-1,2-dicarboxylic acid 2-tert-butyl ester
CAS Number:
1214645-14-3
Molecular Formula:
C19H26NO6-
Molecular Weight:
364.4128
MDL Number:
MFCD07366607
IUPAC Name:
6,7-diethoxy-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinoline-1-carboxylic acid
InChI:
InChI=1S/C19H27NO6/c1-6-24-14-10-12-8-9-20(18(23)26-19(3,4)5)16(17(21)22)13(12)11-15(14)25-7-2/h10-11,16H,6-9H2,1-5H3,(H,21,22)
InChI Key:
SAPMPDOZKGZFPT-UHFFFAOYSA-N
SMILES:
CCOc1cc2c(cc1OCC)CCN(C2C(=O)[O-])C(=O)OC(C)(C)C
Properties
Complexity:
503  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.184g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
365.426g/mol
Monoisotopic Mass:
365.184g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
85.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties