4-(Aminomethyl)oxazole Hydrochloride - CAS 847490-98-6

Catalog:	BB037286
Product Name:	4-(Aminomethyl)oxazole Hydrochloride
CAS:	847490-98-6
Synonyms:	4-oxazolylmethanamine;hydrochloride; 1,3-oxazol-4-ylmethanamine;hydrochloride

Technical Data

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Computed Properties

IUPAC Name:	1,3-oxazol-4-ylmethanamine;hydrochloride
Description:	4-(Aminomethyl)oxazole Hydrochloride (CAS# 847490-98-6 ) is a useful research chemical.
Molecular Weight:	98.10
Molecular Formula:	C4H6N2O·xHCl
Canonical SMILES:	C1=C(N=CO1)CN.Cl
InChI:	InChI=1S/C4H6N2O.ClH/c5-1-4-2-7-3-6-4;/h2-3H,1,5H2;1H
InChI Key:	AFADDGJWYGIXSB-UHFFFAOYSA-N
LogP:	1.63560

Publication Number	Title	Priority Date
WO-2019185631-A1	4â€"(1hâ€" imidazolâ€" 5â€" yl) -1h-pyrrolo [2, 3-b] pyridines for use in the treatment of leukaemias, lymphomas and solid tumors	20180329
AU-2019246220-A1	4â€"(1hâ€" imidazolâ€" 5â€" yl) -1h-pyrrolo (2, 3-b) pyridines for use in the treatment of leukaemias, lymphomas and solid tumors	20180329
AU-2019246220-B2	4â€"(1hâ€" imidazolâ€" 5â€" yl) -1h-pyrrolo (2, 3-b) pyridines for use in the treatment of leukaemias, lymphomas and solid tumors	20180329
CA-3085967-A1	4-(1h-imidazol-5-yl)-1h-pyrrolo[2,3-b]pyridines for use in the treatment of leukaemias, lymphomas and solid tumors	20180329
CN-111936496-A	Use of 4- (1H-imidazol-5-yl) -1H-pyrrolo [2,3-B ] pyridine for the treatment of leukemias, lymphomas and solid tumors	20180329

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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:	57.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	134.0246905
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	134.0246905
Rotatable Bond Count:	1
Topological Polar Surface Area:	52 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0