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1260862-88-1 | 3-Buten-1-amine, N-(2,2,2-trifluoroethyl)-
CAS No: 1260862-88-1 Catalog No: AG000RHW MDL No:
Product Description
Catalog Number:
AG000RHW
Chemical Name:
3-Buten-1-amine, N-(2,2,2-trifluoroethyl)-
CAS Number:
1260862-88-1
Molecular Formula:
C6H10F3N
Molecular Weight:
153.1455
IUPAC Name:
N-(2,2,2-trifluoroethyl)but-3-en-1-amine
InChI:
InChI=1S/C6H10F3N/c1-2-3-4-10-5-6(7,8)9/h2,10H,1,3-5H2
InChI Key:
HSTGWKPJONRTFP-UHFFFAOYSA-N
SMILES:
C=CCCNCC(F)(F)F
Properties
Complexity:
97.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.077g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
153.148g/mol
Monoisotopic Mass:
153.077g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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