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

Technical Data

Safety and Hazards

Patents

Computed Properties

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

Publication Number	Title	Priority Date
CN-109402188-A	A kind of Ï‰-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

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[87-88-7]
Chloranilic acid
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid

Fluorinated Building Blocks

[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[452-76-6]
2,4-Difluorotoluene
[151585-93-2]
2-Amino-6-fluorobenzaldehyde
[1597-32-6]
2-Amino-6-fluoropyridine
[1170836-29-9]
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[351-28-0]
3'-Fluoroacetanilide

Other Pyrimidines

[1597-32-6]
2-Amino-6-fluoropyridine
[13566-71-7]
4(3H)-Pyrimidinone,6-hydroxy-2-phenyl-
[2696462-69-6]
4-(4-Aminopyrimidin-2-yl)-2-methyl-1-(2-trimethylsilylethoxymethyl)pyrazol-3-one
[832739-73-8]
4-(3,5-Dichlorophenyl)pyrimidine-2-thiol
[207605-39-8]
trans-2,3,4,5,6-Pentafluoro-β-nitrostyrene
[551-62-2]
1,2,3,4-Tetrafluorobenzene

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

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