4-(Bromomethyl)-1-methylpiperidine Hydrobromide - CAS 98338-26-2

Catalog:	BB042143
Product Name:	4-(Bromomethyl)-1-methylpiperidine Hydrobromide
CAS:	98338-26-2
Synonyms:	4-(bromomethyl)-1-methylpiperidine;hydrobromide; 4-(bromomethyl)-1-methylpiperidine;hydrobromide

Technical Data

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Computed Properties

IUPAC Name:	4-(bromomethyl)-1-methylpiperidine;hydrobromide
Description:	4-(Bromomethyl)-1-methylpiperidine Hydrobromide (CAS# 98338-26-2) is a useful research chemical.
Molecular Weight:	273.01
Molecular Formula:	C7H15Br2N
Canonical SMILES:	CN1CCC(CC1)CBr.Br
InChI:	InChI=1S/C7H14BrN.BrH/c1-9-4-2-7(6-8)3-5-9;/h7H,2-6H2,1H3;1H
InChI Key:	LPWSSZKXKQCTCS-UHFFFAOYSA-N
LogP:	2.61910

Publication Number	Title	Priority Date
WO-2020103896-A1	Pyrrolo[2,3-b]pyridines as hpk1 inhibitor and uses thereof	20181122
TW-202039483-A	Pyrrolo[2,3-b]pyridines as hpk1 inhibitor and the use thereof	20181122
CN-113166139-A	Pyrrolo [2,3-b ] pyridines as HPK1 inhibitors and uses thereof	20181122
AU-2016328436-A1	New bicyclic compounds as dual ATX/CA inhibitors	20150924
AU-2016328436-B2	New bicyclic compounds as dual ATX/CA inhibitors	20150924

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Related Functional Groups

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	77
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	272.95508
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	270.95712
Rotatable Bond Count:	1
Topological Polar Surface Area:	3.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0