Home Carboxys 2-tert-Butyl 6-methyl 3,4-dihydroisoquinoline-2,6(1h)-dicarboxylate

2-tert-Butyl 6-methyl 3,4-dihydroisoquinoline-2,6(1h)-dicarboxylate

CAS No.:
170097-66-2
Catalog Number:
AG007UFE
Molecular Formula:
C16H21NO4
Molecular Weight:
291.3422
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$126
- +
250mg
95%
In Stock USA
United States
$227
- +
1g
95%
In Stock USA
United States
$454
- +
Product Description
Catalog Number:
AG007UFE
Chemical Name:
2-tert-Butyl 6-methyl 3,4-dihydroisoquinoline-2,6(1h)-dicarboxylate
CAS Number:
170097-66-2
Molecular Formula:
C16H21NO4
Molecular Weight:
291.3422
MDL Number:
MFCD08275038
IUPAC Name:
2-O-tert-butyl 6-O-methyl 3,4-dihydro-1H-isoquinoline-2,6-dicarboxylate
InChI:
InChI=1S/C16H21NO4/c1-16(2,3)21-15(19)17-8-7-11-9-12(14(18)20-4)5-6-13(11)10-17/h5-6,9H,7-8,10H2,1-4H3
InChI Key:
PENHSKQWTCPDFD-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)CCN(C2)C(=O)OC(C)(C)C
Properties
Complexity:
402  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.147g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.347g/mol
Monoisotopic Mass:
291.147g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties