Home Other Building Blocks 2-(3,3,3-trifluoropropanamido)acetic acid

2-(3,3,3-trifluoropropanamido)acetic acid

CAS No.:
923972-81-0
Catalog Number:
AG019V6Y
Molecular Formula:
C5H6F3NO3
Molecular Weight:
185.1012
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Product Description
Catalog Number:
AG019V6Y
Chemical Name:
2-(3,3,3-trifluoropropanamido)acetic acid
CAS Number:
923972-81-0
Molecular Formula:
C5H6F3NO3
Molecular Weight:
185.1012
MDL Number:
MFCD09045159
IUPAC Name:
2-(3,3,3-trifluoropropanoylamino)acetic acid
InChI:
InChI=1S/C5H6F3NO3/c6-5(7,8)1-3(10)9-2-4(11)12/h1-2H2,(H,9,10)(H,11,12)
InChI Key:
HCFKMHVQJRKUQJ-UHFFFAOYSA-N
SMILES:
O=C(CC(F)(F)F)NCC(=O)O
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.03g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
185.102g/mol
Monoisotopic Mass:
185.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties