3-Methylbutanimidamide Hydrochloride - CAS 57297-27-5

Catalog:	BB029634
Product Name:	3-Methylbutanimidamide Hydrochloride
CAS:	57297-27-5
Synonyms:	3-methylbutanimidamide;hydrochloride; 3-methylbutanimidamide;hydrochloride

Technical Data

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Computed Properties

IUPAC Name:	3-methylbutanimidamide;hydrochloride
Description:	3-Methylbutanimidamide Hydrochloride (CAS# 57297-27-5) is a useful research chemical.
Molecular Weight:	136.62
Molecular Formula:	C5H13ClN2
Canonical SMILES:	CC(C)CC(=N)N.Cl
InChI:	InChI=1S/C5H12N2.ClH/c1-4(2)3-5(6)7;/h4H,3H2,1-2H3,(H3,6,7);1H
InChI Key:	SYMBJSDZFDGMCY-UHFFFAOYSA-N
LogP:	2.57050

Publication Number	Title	Priority Date
EP-3203840-A1	Modulators of cystic fibrosis transmembrane conductance regulator	20141006
WO-2016057572-A1	Modulators of cystic fibrosis transmembrane conductance regulator	20141006
AU-2014274644-A1	New thienopyrimidine derivatives, a process for their preparation and pharmaceutical compositions containing them	20131223
AU-2014274644-B2	New thienopyrimidine derivatives, a process for their preparation and pharmaceutical compositions containing them	20131223
CA-2875226-A1	Thienopyrimidine derivatives, process for their preparation, pharmaceutical compositions containing them and their use in the treatment of conditions involving a defect in apoptosis	20131223

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Related Functional Groups

Nitrogen Compounds

[89908-23-6]
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[1243387-55-4]
1-Cyclopropoxy-3-nitro-5-(trifluoromethyl)benzene
[55877-31-1]
1-Benzofuran-3-carbonitrile
[618-40-6]
1-Methyl-1-phenylhydrazine
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	66.5
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	136.0767261
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	136.0767261
Rotatable Bond Count:	2
Topological Polar Surface Area:	49.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0