Home Other Building Blocks octahydropyrano[3,4-b]pyrrol-7-one, trifluoroacetic acid

octahydropyrano[3,4-b]pyrrol-7-one, trifluoroacetic acid

CAS No.:
1423023-84-0
Catalog Number:
AG01A309
Molecular Formula:
C9H12F3NO4
Molecular Weight:
255.1911
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Product Description
Catalog Number:
AG01A309
Chemical Name:
octahydropyrano[3,4-b]pyrrol-7-one, trifluoroacetic acid
CAS Number:
1423023-84-0
Molecular Formula:
C9H12F3NO4
Molecular Weight:
255.1911
MDL Number:
MFCD22628445
IUPAC Name:
2,3,3a,4,5,7a-hexahydro-1H-pyrano[3,4-b]pyrrol-7-one;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C7H11NO2.C2HF3O2/c9-7-6-5(1-3-8-6)2-4-10-7;3-2(4,5)1(6)7/h5-6,8H,1-4H2;(H,6,7)
InChI Key:
KZHNAQKBHGBWCM-UHFFFAOYSA-N
SMILES:
OC(=O)C(F)(F)F.O=C1OCCC2C1NCC2
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.072g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.193g/mol
Monoisotopic Mass:
255.072g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties