3-Amino-3-(4-fluorophenyl)propionic acid - CAS 325-89-3
Catalog: |
BB021338 |
Product Name: |
3-Amino-3-(4-fluorophenyl)propionic acid |
CAS: |
325-89-3 |
Synonyms: |
3-amino-3-(4-fluorophenyl)propanoic acid |
IUPAC Name: | 3-amino-3-(4-fluorophenyl)propanoic acid |
Description: | 3-Amino-3-(4-fluorophenyl)propionic acid (CAS# 325-89-3) is a useful research chemical. |
Molecular Weight: | 183.18 |
Molecular Formula: | C9H10FNO2 |
Canonical SMILES: | C1=CC(=CC=C1C(CC(=O)O)N)F |
InChI: | InChI=1S/C9H10FNO2/c10-7-3-1-6(2-4-7)8(11)5-9(12)13/h1-4,8H,5,11H2,(H,12,13) |
InChI Key: | CPGFMWPQXUXQRX-UHFFFAOYSA-N |
Boiling Point: | 308.8 °C at 760 mmHg |
Melting Point: | 224-228 °C (dec.) |
Purity: | 95 % |
Density: | 1.289 g/cm3 |
MDL: | MFCD00181811 |
LogP: | 2.00050 |
GHS Hazard Statement: | H302 (16.67%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (16.67%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (16.67%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-109402188-A | A kind of ω-transaminase from bacillus pumilus and the application in biological amination | 20181019 |
CN-109402188-B | Omega-transaminase from bacillus pumilus and application of omega-transaminase in biological amination | 20181019 |
EP-3793559-A1 | Substituted dihydropyrazolo pyrazine carboxamide derivatives | 20180517 |
CN-109414441-A | The quinazoline and benzazolyl compounds for treating medical disorder | 20160627 |
RU-2628573-C2 | Dipeptidyl peptidase-4 inhibitor for treatment of type 2 diabetes | 20151127 |
Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 183.06955672 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 183.06955672 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 63.3 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.3 |
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