1-[3,5-Bis(trifluoromethyl)phenyl]cyclobutanemethanamine - CAS 1504202-93-0
Catalog: |
BB010536 |
Product Name: |
1-[3,5-Bis(trifluoromethyl)phenyl]cyclobutanemethanamine |
CAS: |
1504202-93-0 |
Synonyms: |
[1-[3,5-bis(trifluoromethyl)phenyl]cyclobutyl]methanamine; [1-[3,5-bis(trifluoromethyl)phenyl]cyclobutyl]methanamine |
IUPAC Name: | [1-[3,5-bis(trifluoromethyl)phenyl]cyclobutyl]methanamine |
Description: | 1-[3,5-Bis(trifluoromethyl)phenyl]cyclobutanemethanamine (CAS# 1504202-93-0 ) is a useful research chemical. |
Molecular Weight: | 297.24 |
Molecular Formula: | C13H13F6N |
Canonical SMILES: | C1CC(C1)(CN)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F |
InChI: | InChI=1S/C13H13F6N/c14-12(15,16)9-4-8(11(7-20)2-1-3-11)5-10(6-9)13(17,18)19/h4-6H,1-3,7,20H2 |
InChI Key: | JZVLLEQNTQUQAO-UHFFFAOYSA-N |
LogP: | 4.80490 |
Complexity: | 322 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 297.09521839 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 297.09521839 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.8 |
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