Home Carboxys 1-(2,2,2-Trifluoroacetyl)-3-azetidinecarboxylic acid

1-(2,2,2-Trifluoroacetyl)-3-azetidinecarboxylic acid

CAS No.:
1001026-41-0
Catalog Number:
AG00H95U
Molecular Formula:
C6H6F3NO3
Molecular Weight:
197.1119
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$32
- +
5g
97%
In Stock USA
United States
$144
- +
25g
97%
In Stock USA
United States
$600
- +
100g
97%
In Stock USA
United States
$2000
- +
Product Description
Catalog Number:
AG00H95U
Chemical Name:
1-(2,2,2-Trifluoroacetyl)-3-azetidinecarboxylic acid
CAS Number:
1001026-41-0
Molecular Formula:
C6H6F3NO3
Molecular Weight:
197.1119
MDL Number:
MFCD22421758
IUPAC Name:
1-(2,2,2-trifluoroacetyl)azetidine-3-carboxylic acid
InChI:
InChI=1S/C6H6F3NO3/c7-6(8,9)5(13)10-1-3(2-10)4(11)12/h3H,1-2H2,(H,11,12)
InChI Key:
FMPNGUOKMPVJQV-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)N1CC(C1)C(=O)O
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.03g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
197.113g/mol
Monoisotopic Mass:
197.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties