2-Chloro-5-fluorobenzylamine - CAS 202522-23-4

Name: 2-Chloro-5-fluorobenzylamine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB015736
Product Name:	2-Chloro-5-fluorobenzylamine
CAS:	202522-23-4
Synonyms:	(2-chloro-5-fluorophenyl)methanamine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(2-chloro-5-fluorophenyl)methanamine
Description:	2-Chloro-5-fluorobenzylamine (CAS# 202522-23-4) is a useful research chemical.
Molecular Weight:	159.59
Molecular Formula:	C7H7ClFN
Canonical SMILES:	C1=CC(=C(C=C1F)CN)Cl
InChI:	InChI=1S/C7H7ClFN/c8-7-2-1-6(9)3-5(7)4-10/h1-3H,4,10H2
InChI Key:	IGFBMQSUHFQVFE-UHFFFAOYSA-N
Boiling Point:	212.9 °C at 760 mmHg
Purity:	95 %
Density:	1.27 g/cm³
MDL:	MFCD06213626
LogP:	2.63810

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Related Functional Groups

Fluorinated Building Blocks

[1427357-61-6]C6H4FN3
6-Fluoro-[1,2,4]triazolo[1,5-a]pyridine
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[459836-92-1]C8H6F2O2
3,6-Difluoro-2-methylbenzoic acid
[1795420-51-7]C6H6F3N3O2
3-Amino-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxylic acid
[150517-77-4]C8H7F4N
3-Fluoro-5-(trifluoromethyl)benzylamine
[2091593-59-6]C9H10F3NO
3-methoxy-6-methyl-2-(trifluoromethyl)aniline

Nitrogen Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[333311-69-6]C12H12BrN3O2
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[51355-91-0]C6H8ClN3O2
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]C4H4ClN3O2
1-(Chloromethyl)-3-nitro-1H-pyrazole
[55877-31-1]C9H5NO
1-Benzofuran-3-carbonitrile

Other Pyrimidines

[1183749-69-0]C10H8N2O2
2-(pyrimidin-2-yloxy)phenol
[1597-32-6]C5H5FN2
2-Amino-6-fluoropyridine
[1632145-37-9]0
3-Methyl-3-(perfluoropyridin-4-yl)-1,5-dioxaspiro[5.5]undecane-2,4-dione
[451-46-7]C9H9FO2
Ethyl 4-fluorobenzoate
[551-62-2]C6H2F4
1,2,3,4-Tetrafluorobenzene
[1489-53-8]C6H3F3
1,2,3-Trifluorobenzene

GHS Hazard Statement:	H301 (88.37%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P260, P264, P270, P280, P301+P310, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
US-2020405706-A1	Tetrahydroquinoline derivatives as p2x7 receptor antagonists	20170313
US-2021085667-A1	Tetrahydroquinoline derivatives as p2x7 receptor antagonists	20170313
US-11077100-B2	Tetrahydroquinoline derivatives as P2X7 receptor antagonists	20170313
WO-2017114275-A1	Compound for inhibiting rock, preparation method and use of same	20151231
US-10017512-B2	Compounds and compositions useful for treating disorders related to NTRK	20150826

Complexity:	110
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	159.0251051
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	159.0251051
Rotatable Bond Count:	1
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5