1-(2,4-Difluorophenyl)cyclopentanamine - CAS 1340120-25-3

Catalog:	BB007856
Product Name:	1-(2,4-Difluorophenyl)cyclopentanamine
CAS:	1340120-25-3
Synonyms:	1-(2,4-difluorophenyl)-1-cyclopentanamine; 1-(2,4-difluorophenyl)cyclopentan-1-amine

Technical Data

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Computed Properties

IUPAC Name:	1-(2,4-difluorophenyl)cyclopentan-1-amine
Description:	1-(2,4-Difluorophenyl)cyclopentanamine (CAS# 1340120-25-3 ) is a useful research chemical.
Molecular Weight:	197.22
Molecular Formula:	C11H13F2N
Canonical SMILES:	C1CCC(C1)(C2=C(C=C(C=C2)F)F)N
InChI:	InChI=1S/C11H13F2N/c12-8-3-4-9(10(13)7-8)11(14)5-1-2-6-11/h3-4,7H,1-2,5-6,14H2
InChI Key:	OYAZOLKGTMSJIF-UHFFFAOYSA-N
LogP:	3.39310

Publication Number	Title	Priority Date
US-2016237057-A1	Diarylalkylamine rev-erb antagonists and their use as medicaments	20131009
US-2017136009-A1	Diarylalkylamine rev-erb antagonists and their use as medicaments	20131009
US-9611245-B2	Diarylalkylamine REV-ERB antagonists and their use as medicaments	20131009
US-9949968-B2	Diarylalkylamine REV-ERB antagonists and their use as medicaments	20131009
EP-2822954-B1	Polycyclic-carbamoylpyridone compounds and their pharmaceutical use	20121221

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	202
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	197.10160574
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	197.10160574
Rotatable Bond Count:	1
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2