5-Amino-2-fluorobenzyl Alcohol - CAS 84832-00-8
Catalog: |
BB037328 |
Product Name: |
5-Amino-2-fluorobenzyl Alcohol |
CAS: |
84832-00-8 |
Synonyms: |
(5-amino-2-fluorophenyl)methanol; (5-amino-2-fluorophenyl)methanol |
IUPAC Name: | (5-amino-2-fluorophenyl)methanol |
Description: | 5-Amino-2-fluorobenzyl Alcohol (CAS# 84832-00-8) is a useful research chemical. |
Molecular Weight: | 141.14 |
Molecular Formula: | C7H8FNO |
Canonical SMILES: | C1=CC(=C(C=C1N)CO)F |
InChI: | InChI=1S/C7H8FNO/c8-7-2-1-6(9)3-5(7)4-10/h1-3,10H,4,9H2 |
InChI Key: | NBVPTQRFNRBXGB-UHFFFAOYSA-N |
Boiling Point: | 295.4 °C at 760 mmHg |
Density: | 1.286 g/cm3 |
MDL: | MFCD03094257 |
LogP: | 1.48140 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2015226855-A1 | Human plasma kallikrein inhibitors | 20140307 |
CA-2941380-A1 | Human plasma kallikrein inhibitors | 20140307 |
CN-106257976-A | Human plasma kallikrein inhibitor | 20140307 |
EP-3113772-A1 | Human plasma kallikrein inhibitors | 20140307 |
JP-2017507160-A | Human plasma kallikrein inhibitor | 20140307 |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 141.058992041 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 141.058992041 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 46.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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