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303049-75-4 | Benzenemethanamine, α-methyl-N-(2,2,2-trifluoroethyl)-
CAS No: 303049-75-4 Catalog No: AG002ZLL MDL No:
Product Description
Catalog Number:
AG002ZLL
Chemical Name:
Benzenemethanamine, α-methyl-N-(2,2,2-trifluoroethyl)-
CAS Number:
303049-75-4
Molecular Formula:
C10H12F3N
Molecular Weight:
203.2042
IUPAC Name:
2,2,2-trifluoro-N-(1-phenylethyl)ethanamine
InChI:
InChI=1S/C10H12F3N/c1-8(14-7-10(11,12)13)9-5-3-2-4-6-9/h2-6,8,14H,7H2,1H3
InChI Key:
OSMHFAPZPMZUSZ-UHFFFAOYSA-N
SMILES:
CC(c1ccccc1)NCC(F)(F)F
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.092g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.208g/mol
Monoisotopic Mass:
203.092g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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