Home Carbonyls (4S)-4-[(tert-Butoxycarbonyl)amino]-1-methyl-l-proline hydrate

(4S)-4-[(tert-Butoxycarbonyl)amino]-1-methyl-l-proline hydrate

CAS No.:
1609388-31-9
Catalog Number:
AG00J28T
Molecular Formula:
C11H22N2O5
Molecular Weight:
262.3028
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$289
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Product Description
Catalog Number:
AG00J28T
Chemical Name:
(4S)-4-[(tert-Butoxycarbonyl)amino]-1-methyl-l-proline hydrate
CAS Number:
1609388-31-9
Molecular Formula:
C11H22N2O5
Molecular Weight:
262.3028
MDL Number:
MFCD18447650
IUPAC Name:
(2S,4S)-1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-2-carboxylic acid;hydrate
InChI:
InChI=1S/C11H20N2O4.H2O/c1-11(2,3)17-10(16)12-7-5-8(9(14)15)13(4)6-7;/h7-8H,5-6H2,1-4H3,(H,12,16)(H,14,15);1H2/t7-,8-;/m0./s1
InChI Key:
ZGMWHKOCLJXCQY-WSZWBAFRSA-N
SMILES:
O=C(OC(C)(C)C)N[C@@H]1CN([C@@H](C1)C(=O)O)C.O
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
262.153g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
262.306g/mol
Monoisotopic Mass:
262.153g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
79.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties