Home Other Building Blocks N3-cyclopropyl-4,4,4-trifluorobutane-1,3-diamine

N3-cyclopropyl-4,4,4-trifluorobutane-1,3-diamine

CAS No.:
2126161-68-8
Catalog Number:
AG01EK24
Molecular Formula:
C7H13F3N2
Molecular Weight:
182.1867
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Product Description
Catalog Number:
AG01EK24
Chemical Name:
N3-cyclopropyl-4,4,4-trifluorobutane-1,3-diamine
CAS Number:
2126161-68-8
Molecular Formula:
C7H13F3N2
Molecular Weight:
182.1867
MDL Number:
MFCD31381437
IUPAC Name:
3-N-cyclopropyl-4,4,4-trifluorobutane-1,3-diamine
InChI:
InChI=1S/C7H13F3N2/c8-7(9,10)6(3-4-11)12-5-1-2-5/h5-6,12H,1-4,11H2
InChI Key:
QBXFMBNLKXDUOV-UHFFFAOYSA-N
SMILES:
NCCC(C(F)(F)F)NC1CC1
Properties
Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.103g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
182.19g/mol
Monoisotopic Mass:
182.103g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties