3-(2,6-Difluorophenyl)-1-propylamine - CAS 401940-05-4
Catalog: |
BB024360 |
Product Name: |
3-(2,6-Difluorophenyl)-1-propylamine |
CAS: |
401940-05-4 |
Synonyms: |
3-(2,6-difluorophenyl)-1-propanamine; 3-(2,6-difluorophenyl)propan-1-amine |
IUPAC Name: | 3-(2,6-difluorophenyl)propan-1-amine |
Description: | 3-(2,6-Difluorophenyl)-1-propylamine (CAS# 401940-05-4 ) is a useful research chemical. |
Molecular Weight: | 171.19 |
Molecular Formula: | C9H11F2N |
Canonical SMILES: | C1=CC(=C(C(=C1)F)CCCN)F |
InChI: | InChI=1S/C9H11F2N/c10-8-4-1-5-9(11)7(8)3-2-6-12/h1,4-5H,2-3,6,12H2 |
InChI Key: | MEORPDCIWSZWLU-UHFFFAOYSA-N |
LogP: | 2.55640 |
Publication Number | Title | Priority Date |
TW-201738203-A | Tertiary guanamine and method of use | 20160406 |
US-2019119200-A1 | Tertiary amides and method of use | 20160406 |
WO-2017177004-A1 | Tertiary amides and method of use | 20160406 |
CA-2417361-C | New phenyl- and phenylalkyl-substituted ethanolamines and ethylenediamines | 20000818 |
DE-10040901-A1 | New phenyl- and phenylalkyl-substituted ethanolamines and ethylenediamines | 20000818 |
Complexity: | 120 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.08595568 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.08595568 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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