Home Other Building Blocks 3-(fluoromethyl)azetidine, trifluoroacetic acid

3-(fluoromethyl)azetidine, trifluoroacetic acid

CAS No.:
1443983-84-3
Catalog Number:
AG01C2SV
Molecular Formula:
C6H9F4NO2
Molecular Weight:
203.1348
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Product Description
Catalog Number:
AG01C2SV
Chemical Name:
3-(fluoromethyl)azetidine, trifluoroacetic acid
CAS Number:
1443983-84-3
Molecular Formula:
C6H9F4NO2
Molecular Weight:
203.1348
MDL Number:
MFCD29055124
IUPAC Name:
3-(fluoromethyl)azetidine;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C4H8FN.C2HF3O2/c5-1-4-2-6-3-4;3-2(4,5)1(6)7/h4,6H,1-3H2;(H,6,7)
InChI Key:
GEKBIXJKXKSUDP-UHFFFAOYSA-N
SMILES:
OC(=O)C(F)(F)F.FCC1CNC1
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.057g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
203.137g/mol
Monoisotopic Mass:
203.057g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties