4-Amino-1-methylpyrazole Hydrochloride - CAS 127107-23-7

Catalog:	BB006730
Product Name:	4-Amino-1-methylpyrazole Hydrochloride
CAS:	127107-23-7
Synonyms:	1-methyl-4-pyrazolamine;hydrochloride; 1-methylpyrazol-4-amine;hydrochloride

Technical Data

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Computed Properties

IUPAC Name:	1-methylpyrazol-4-amine;hydrochloride
Description:	4-Amino-1-methylpyrazole Hydrochloride (CAS# 127107-23-7) is a useful research chemical.
Molecular Weight:	133.58
Molecular Formula:	C4H8ClN3
Canonical SMILES:	CN1C=C(C=N1)N.Cl
InChI:	InChI=1S/C4H7N3.ClH/c1-7-3-4(5)2-6-7;/h2-3H,5H2,1H3;1H
InChI Key:	OKPCAONVUKBJJQ-UHFFFAOYSA-N
Boiling Point:	231.4 °C at 760 mmHg
Density:	1.22 g/cm³
MDL:	MFCD07626616
LogP:	0.58350

Publication Number	Title	Priority Date
CN-111646978-A	N2-substituted alkoxy aromatic ring-2-aminopyrimidine derivatives and application thereof	20200611
WO-2021197276-A1	Amide compounds and uses thereof	20200330
CN-112625036-A	Compound with BRD4 inhibitory activity, preparation method and application thereof	20191008
WO-2021068755-A1	Compound having brd4 inhibitory activity, preparation method therefor and use thereof	20191008
CN-112142743-A	Heterocyclic compound, preparation method and application thereof in medicine and pharmacology	20190628

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GHS Hazard Statement:	H302 (33.33%): 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:	64
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	133.0406750
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	133.0406750
Rotatable Bond Count:	0
Topological Polar Surface Area:	43.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0