Home Carboxys tert-Butyl (3as,6as)-rel-octahydropyrrolo[3,4-c]pyrrole-2-carboxylate hemioxalate

tert-Butyl (3as,6as)-rel-octahydropyrrolo[3,4-c]pyrrole-2-carboxylate hemioxalate

CAS No.:
1818847-81-2
Catalog Number:
AG00236Q
Molecular Formula:
C24H42N4O8
Molecular Weight:
514.6123
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$778
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Product Description
Catalog Number:
AG00236Q
Chemical Name:
tert-Butyl (3as,6as)-rel-octahydropyrrolo[3,4-c]pyrrole-2-carboxylate hemioxalate
CAS Number:
1818847-81-2
Molecular Formula:
C24H42N4O8
Molecular Weight:
514.6123
MDL Number:
MFCD29921777
IUPAC Name:
tert-butyl (3aS,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole-5-carboxylate;oxalic acid
InChI:
InChI=1S/2C11H20N2O2.C2H2O4/c2*1-11(2,3)15-10(14)13-6-8-4-12-5-9(8)7-13;3-1(4)2(5)6/h2*8-9,12H,4-7H2,1-3H3;(H,3,4)(H,5,6)/t2*8-,9-;/m00./s1
InChI Key:
VAWQHBFBQPFJEO-LVAJUWGCSA-N
SMILES:
O=C(N1C[C@H]2[C@H](C1)CNC2)OC(C)(C)C.O=C(N1C[C@H]2[C@H](C1)CNC2)OC(C)(C)C.OC(=O)C(=O)O
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
514.3g/mol
Formal Charge:
0
Heavy Atom Count:
36  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
514.62g/mol
Monoisotopic Mass:
514.3g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
158A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties