3,5-Difluorobenzylamine - CAS 90390-27-5

Name: 3,5-Difluorobenzylamine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB039840
Product Name:	3,5-Difluorobenzylamine
CAS:	90390-27-5
Synonyms:	(3,5-difluorophenyl)methanamine

Technical Data

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Computed Properties

IUPAC Name:	(3,5-difluorophenyl)methanamine
Description:	3,5-Difluorobenzylamine (CAS# 90390-27-5) is a useful reagent for reductive amination.
Molecular Weight:	143.13
Molecular Formula:	C7H7F2N
Canonical SMILES:	C1=C(C=C(C=C1F)F)CN
InChI:	InChI=1S/C7H7F2N/c8-6-1-5(4-10)2-7(9)3-6/h1-3H,4,10H2
InChI Key:	VJNGGOMRUHYAMC-UHFFFAOYSA-N
Boiling Point:	184 °C
Purity:	98 %
Density:	1.21 g/cm³
Appearance:	Clear yellow liquid
MDL:	MFCD00061244
LogP:	2.12380

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Related Functional Groups

Fluorinated Building Blocks

[1006473-17-1]C13H15F2N3
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1866059-82-6]C4H6F4O2S
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[479552-94-8]C8H5F3N2O3S
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[35989-28-7]C7H3Cl2FO2
2,5-Dichloro-4-fluorobenzoic acid
[1597-32-6]C5H5FN2
2-Amino-6-fluoropyridine

Nitrogen Compounds

[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[62838-59-9]C8H12N2
1-Cyclopentyl-1H-pyrazole
[1243387-55-4]C10H8F3NO3
1-Cyclopropoxy-3-nitro-5-(trifluoromethyl)benzene
[13021-14-2]C10H15N
2,4,6-Trimethyl-N-methylaniline
[1170836-29-9]C12H12F3N5
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[158387-00-9]C9H11N3O
3-Oxo-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propanenitrile

Other Pyrimidines

[937601-34-8]C9H8BrN3O2
3-Bromo-2,5-dimethylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
[832739-73-8]C10H6Cl2N2S
4-(3,5-Dichlorophenyl)pyrimidine-2-thiol
[451-46-7]C9H9FO2
Ethyl 4-fluorobenzoate
[81290-20-2]C4H9F3Si
Trimethyl(trifluoromethyl)silane
[207605-39-8]C8H2F5NO2
trans-2,3,4,5,6-Pentafluoro-β-nitrostyrene
[551-62-2]C6H2F4
1,2,3,4-Tetrafluorobenzene

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
CN-113292510-A	Benzisothiazole compound for inhibiting hypoxia inducible factor 2 activity, preparation method and application thereof	20210607
CN-112979646-A	Imidazopyridine derivative	20210308
CN-112608275-A	Application of 2, 8-bis (trifluoromethyl) -4-hydroxyquinoline derivative in preparation and prevention and treatment of agricultural diseases	20201229
CN-112552232-A	Pyridone hexa-alkynylamine modified derivative and preparation method and application thereof	20201216
CN-111909113-A	Synthesis method of 2-substituted benzothiazole compound under catalyst-free and additive-free conditions	20200805

PMID	Publication Date	Title	Journal
19441049	20090601	Determination of sub-ppb epichlorohydrin levels in water by on-line solid-phase extraction liquid chromatography/tandem mass spectrometry	Rapid communications in mass spectrometry : RCM
6433022	19840901	Benzylamines: synthesis and evaluation of antimycobacterial properties	Journal of medicinal chemistry

Complexity:	97.8
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	143.05465555
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	143.05465555
Rotatable Bond Count:	1
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1