Home Nitros 1,1,1-trifluoro-3-nitro-butan-2-ol

1,1,1-trifluoro-3-nitro-butan-2-ol

CAS No.:
434-39-9
Catalog Number:
AG00DZCX
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00DZCX
Chemical Name:
1,1,1-trifluoro-3-nitro-butan-2-ol
CAS Number:
434-39-9
MDL Number:
MFCD29060244
IUPAC Name:
1,1,1-trifluoro-3-nitrobutan-2-ol
InChI:
InChI=1S/C4H6F3NO3/c1-2(8(10)11)3(9)4(5,6)7/h2-3,9H,1H3
InChI Key:
PKQGAGPKSOAOPY-UHFFFAOYSA-N
NSC Number:
3640
Properties
Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.03g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
173.091g/mol
Monoisotopic Mass:
173.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties