Home Other Building Blocks Azetidine, 3-(2-propen-1-yl)-, 2,2,2-trifluoroacetate (1:1)

Azetidine, 3-(2-propen-1-yl)-, 2,2,2-trifluoroacetate (1:1)

CAS No.:
1630906-83-0
Catalog Number:
AG001TR1
Molecular Formula:
C8H12F3NO2
Molecular Weight:
211.1816
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Product Description
Catalog Number:
AG001TR1
Chemical Name:
Azetidine, 3-(2-propen-1-yl)-, 2,2,2-trifluoroacetate (1:1)
CAS Number:
1630906-83-0
Molecular Formula:
C8H12F3NO2
Molecular Weight:
211.1816
MDL Number:
MFCD28166304
IUPAC Name:
3-prop-2-enylazetidine;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C6H11N.C2HF3O2/c1-2-3-6-4-7-5-6;3-2(4,5)1(6)7/h2,6-7H,1,3-5H2;(H,6,7)
InChI Key:
VQWLDBPVYSBGKF-UHFFFAOYSA-N
SMILES:
OC(=O)C(F)(F)F.C=CCC1CNC1
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.082g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
211.184g/mol
Monoisotopic Mass:
211.082g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties