3-Trifluoromethyl-L-β-homophenylglycine - CAS 793663-51-1

Catalog:	BB054620
Product Name:	3-Trifluoromethyl-L-β-homophenylglycine
CAS:	793663-51-1
Synonyms:	H-Phg(3-CF3)-(C#CH2)OH; H-β-Phe(3-CF3)-OH; (R)-3-Amino-3-(3-trifluoromethylphenyl)propanoic acid

Technical Data

Computed Properties

IUPAC Name:	(3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoic acid
Molecular Weight:	233.19
Molecular Formula:	C10H10F3NO2
Canonical SMILES:	C1=CC(=CC(=C1)C(F)(F)F)C(CC(=O)O)N
InChI:	InChI=1S/C10H10F3NO2/c11-10(12,13)7-3-1-2-6(4-7)8(14)5-9(15)16/h1-4,8H,5,14H2,(H,15,16)/t8-/m1/s1
InChI Key:	WZXBASRNQXYUIP-MRVPVSSYSA-N
Boiling Point:	295.2±40.0 °C at 760 mmHg
Density:	1.361±0.06 g/cm3
Storage:	Store at 2-8 °C

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Related Functional Groups

Amines and Anilines

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(3R,4R)-4-Amino-3-methoxytetrahydropyran
[1006473-17-1]
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1225940-17-9]
1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine
[1820736-42-2]
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[1824357-78-9]
2-(1-Benzyl-3-pyrazolyl)ethylamine
[17583-40-3]
2-(Methylamino)benzonitrile

Carbonyl Compounds

[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[87-88-7]
Chloranilic acid
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[55441-25-3]
1-(2-Cyanophenyl)urea
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone

Fluorinated Building Blocks

[1427357-61-6]
6-Fluoro-[1,2,4]triazolo[1,5-a]pyridine
[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[479552-94-8]
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[1011396-69-2]
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine
[35989-28-7]
2,5-Dichloro-4-fluorobenzoic acid
[1597-32-6]
2-Amino-6-fluoropyridine

Oxygen Compounds

[134769-80-5]
3-Methylphenylacetaldehyde dimethyl acetal
[52378-69-5]
Diethyl trans-cinnamylphosphonate
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[1281984-38-0]
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

Complexity:	255
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	233.06636305
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	233.06636305
Rotatable Bond Count:	3
Topological Polar Surface Area:	63.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.5