Benzylamine hydrochloride - CAS 3287-99-8

Catalog:	BB021455
Product Name:	Benzylamine hydrochloride
CAS:	3287-99-8
Synonyms:	phenylmethanamine;hydrochloride

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	phenylmethanamine;hydrochloride
Description:	Benzylamine hydrochloride is a natural compound isolated from the herbs of Moringa oleifera.
Molecular Weight:	143.61
Molecular Formula:	C7H10ClN
Canonical SMILES:	C1=CC=C(C=C1)CN.Cl
InChI:	InChI=1S/C7H9N.ClH/c8-6-7-4-2-1-3-5-7;/h1-5H,6,8H2;1H
InChI Key:	XKXHCNPAFAXVRZ-UHFFFAOYSA-N
Boiling Point:	185 ℃ at 760 mmHg
Melting Point:	253 ℃
Purity:	> 98.0 % (T) (HPLC)
Solubility:	>21.5 [ug/mL] (The mean of the results at pH 7.4)
Appearance:	Powder
Storage:	Store under inert gas
MDL:	MFCD00012852
LogP:	2.64760
Vapor Pressure:	0.00000172 [mmHg]

Publication Number	Title	Priority Date
US-10799530-B1	Composition and method for the prevention and treatment of obesity	20191220
US-10933091-B1	Composition and method for the treatment of type I diabetes	20191220
US-2021187015-A1	Composition and method for the prevention and treatment of type 2 diabetes	20191220
US-2021187016-A1	Method of treating nonalcoholic steatohepatitis	20191220
US-2021187017-A1	Composition and method for the prevention and treatment of obesity	20191220

PMID	Publication Date	Title	Journal
31153898	20190901	Evaluation of brain SERT with 4-[18F]-ADAM/micro-PET and hearing protective effects of dextromethorphan in hearing loss rat model	Toxicology and applied pharmacology
27074625	20160526	Development and Characterization of a Potent Free Fatty Acid Receptor 1 (FFA1) Fluorescent Tracer	Journal of medicinal chemistry
24064863	20131114	Enantioselective synthesis of encecaline-derived potent antimalarial agents	Organic & biomolecular chemistry
23018155	20121105	A seven-coordinated manganese(II) complex with V-shaped ligand bis(N-benzylbenzimidazol-2-ylmethyl)benzylamine: synthesis, structure, DNA-binding properties and antioxidant activities	Journal of photochemistry and photobiology. B, Biology
22944335	20121001	O-Hydroxyl- or o-amino benzylamine-tacrine hybrids: multifunctional biometals chelators, antioxidants, and inhibitors of cholinesterase activity and amyloid-β aggregation	Bioorganic & medicinal chemistry

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Related Functional Groups

Nitrogen Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[51355-91-0]
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[55877-31-1]
1-Benzofuran-3-carbonitrile

GHS Hazard Statement:	H302 (95.65%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	55.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	143.0501770
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	143.0501770
Rotatable Bond Count:	1
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0