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89091-34-9

89091-34-9 | 1-Propanamine, 3,3-dichloro-3-fluoro-2-methyl-

CAS No: 89091-34-9 Catalog No: AG003Z1L MDL No:

Product Description

Catalog Number:
AG003Z1L
Chemical Name:
1-Propanamine, 3,3-dichloro-3-fluoro-2-methyl-
CAS Number:
89091-34-9
Molecular Formula:
C4H8Cl2FN
Molecular Weight:
160.0174
IUPAC Name:
3,3-dichloro-3-fluoro-2-methylpropan-1-amine
InChI:
InChI=1S/C4H8Cl2FN/c1-3(2-8)4(5,6)7/h3H,2,8H2,1H3
InChI Key:
YILBKBXNQJYNCE-UHFFFAOYSA-N
SMILES:
NCC(C(Cl)(Cl)F)C

Properties

Complexity:
76.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.002g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
160.013g/mol
Monoisotopic Mass:
159.002g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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