Home Carboxys tert-Butyl 5-benzylhexahydropyrrolo[3,4-c]pyrrole-2(1h)-carboxylate

tert-Butyl 5-benzylhexahydropyrrolo[3,4-c]pyrrole-2(1h)-carboxylate

CAS No.:
186202-73-3
Catalog Number:
AG00ANJB
Molecular Formula:
C18H26N2O2
Molecular Weight:
302.4112
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$391
- +
1g
97%
1 week
United States
$920
- +
Product Description
Catalog Number:
AG00ANJB
Chemical Name:
tert-Butyl 5-benzylhexahydropyrrolo[3,4-c]pyrrole-2(1h)-carboxylate
CAS Number:
186202-73-3
Molecular Formula:
C18H26N2O2
Molecular Weight:
302.4112
MDL Number:
MFCD18909636
IUPAC Name:
tert-butyl 2-benzyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carboxylate
InChI:
InChI=1S/C18H26N2O2/c1-18(2,3)22-17(21)20-12-15-10-19(11-16(15)13-20)9-14-7-5-4-6-8-14/h4-8,15-16H,9-13H2,1-3H3
InChI Key:
WUEVXPVJRUPJLC-UHFFFAOYSA-N
SMILES:
O=C(N1CC2C(C1)CN(C2)Cc1ccccc1)OC(C)(C)C
Properties
Complexity:
384  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.199g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.418g/mol
Monoisotopic Mass:
302.199g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties