Home Carboxys Boc-(2s,3as,7as)-octahydro-1H-indole-2-carboxylic acid

Boc-(2s,3as,7as)-octahydro-1H-indole-2-carboxylic acid

CAS No.:
109523-13-9
Catalog Number:
AG007T0A
Molecular Formula:
C14H23NO4
Molecular Weight:
269.3367
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥ 99% (HPLC)
1 week
United States
$89
- +
1g
≥ 99% (HPLC)
1 week
United States
$155
- +
5g
≥ 99% (HPLC)
1 week
United States
$418
- +
10g
≥ 99% (HPLC)
1 week
United States
$696
- +
25g
≥ 99% (HPLC)
1 week
United States
$1493
- +
Product Description
Catalog Number:
AG007T0A
Chemical Name:
Boc-(2s,3as,7as)-octahydro-1H-indole-2-carboxylic acid
CAS Number:
109523-13-9
Molecular Formula:
C14H23NO4
Molecular Weight:
269.3367
MDL Number:
MFCD09750486
IUPAC Name:
(2S,3aS,7aS)-1-[(2-methylpropan-2-yl)oxycarbonyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid
InChI:
InChI=1S/C14H23NO4/c1-14(2,3)19-13(18)15-10-7-5-4-6-9(10)8-11(15)12(16)17/h9-11H,4-8H2,1-3H3,(H,16,17)/t9-,10-,11-/m0/s1
InChI Key:
POJYGQHOQQDGQZ-DCAQKATOSA-N
SMILES:
OC(=O)[C@@H]1C[C@H]2[C@@H](N1C(=O)OC(C)(C)C)CCCC2
Properties
Complexity:
374  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0
Exact Mass:
269.163g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
269.341g/mol
Monoisotopic Mass:
269.163g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties