Home Other Building Blocks 1,1,1-trifluoro-3-(pyrrolidin-1-yl)propan-2-ol

1,1,1-trifluoro-3-(pyrrolidin-1-yl)propan-2-ol

CAS No.:
959045-77-3
Catalog Number:
AG01AHIS
Molecular Formula:
C7H12F3NO
Molecular Weight:
183.1715
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Product Description
Catalog Number:
AG01AHIS
Chemical Name:
1,1,1-trifluoro-3-(pyrrolidin-1-yl)propan-2-ol
CAS Number:
959045-77-3
Molecular Formula:
C7H12F3NO
Molecular Weight:
183.1715
MDL Number:
MFCD00466829
IUPAC Name:
1,1,1-trifluoro-3-pyrrolidin-1-ylpropan-2-ol
InChI:
InChI=1S/C7H12F3NO/c8-7(9,10)6(12)5-11-3-1-2-4-11/h6,12H,1-5H2
InChI Key:
NFDYPZXRSNWUHC-UHFFFAOYSA-N
SMILES:
OC(C(F)(F)F)CN1CCCC1
Properties
Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.087g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
183.174g/mol
Monoisotopic Mass:
183.087g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties