3-Fluoro-4-(trifluoromethoxy)benzylamine - CAS 886499-13-4
Catalog: |
BB039106 |
Product Name: |
3-Fluoro-4-(trifluoromethoxy)benzylamine |
CAS: |
886499-13-4 |
Synonyms: |
[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine; [3-fluoro-4-(trifluoromethoxy)phenyl]methanamine |
IUPAC Name: | [3-fluoro-4-(trifluoromethoxy)phenyl]methanamine |
Description: | 3-Fluoro-4-(trifluoromethoxy)benzylamine (CAS# 886499-13-4) is a useful research chemical. |
Molecular Weight: | 209.14 |
Molecular Formula: | C8H7F4NO |
Canonical SMILES: | C1=CC(=C(C=C1CN)F)OC(F)(F)F |
InChI: | InChI=1S/C8H7F4NO/c9-6-3-5(4-13)1-2-7(6)14-8(10,11)12/h1-3H,4,13H2 |
InChI Key: | LKKOOHKPOMOOAI-UHFFFAOYSA-N |
Boiling Point: | 195 °C at 760 mmHg |
Density: | 1.357 g/cm3 |
Appearance: | Solid |
LogP: | 2.88330 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-105505128-A | Near-infrared light response type self-repair coating and preparation method thereof | 20160223 |
KR-20150052419-A | Biguanide compounds and use thereof | 20131104 |
US-10221190-B2 | Biguanide compounds and use thereof | 20131104 |
US-2015126518-A1 | Biguanide compounds and use thereof | 20131104 |
US-2019144464-A1 | Biguanide compounds and use thereof | 20131104 |
Complexity: | 185 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 209.0463765 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 209.0463765 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 35.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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