Home Carboxys 2-N-Boc-1,2,3,4-tetrahydro-isoquinoline-1-carboxylic acid

2-N-Boc-1,2,3,4-tetrahydro-isoquinoline-1-carboxylic acid

CAS No.:
166591-85-1
Catalog Number:
AG001WU7
Molecular Formula:
C15H18NO4-
Molecular Weight:
276.3077
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$69
- +
1g
98%
In Stock USA
United States
$169
- +
5g
98%
In Stock USA
United States
$563
- +
10g
98%
In Stock USA
United States
$838
- +
25g
98%
In Stock USA
United States
$1575
- +
Product Description
Catalog Number:
AG001WU7
Chemical Name:
2-N-Boc-1,2,3,4-tetrahydro-isoquinoline-1-carboxylic acid
CAS Number:
166591-85-1
Molecular Formula:
C15H18NO4-
Molecular Weight:
276.3077
MDL Number:
MFCD08274995
IUPAC Name:
2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinoline-1-carboxylic acid
InChI:
InChI=1S/C15H19NO4/c1-15(2,3)20-14(19)16-9-8-10-6-4-5-7-11(10)12(16)13(17)18/h4-7,12H,8-9H2,1-3H3,(H,17,18)
InChI Key:
KMTRFKAFNRHBCH-UHFFFAOYSA-N
SMILES:
O=C(N1CCc2c(C1C(=O)[O-])cccc2)OC(C)(C)C
Properties
Complexity:
388  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.131g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
277.32g/mol
Monoisotopic Mass:
277.131g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties