4-Methoxy-2-naphthylamine - CAS 2764-95-6

Name: 4-Methoxy-2-naphthylamine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Technical Data

IUPAC Name:	4-methoxynaphthalen-2-amine
Description:	4-Methoxy-2-naphthylamine (CAS# 2764-95-6) is an intermediate in synthesizing Monocrotaline-d4 (M526002), a labelled Monocrotaline (M526000) which is a toxic pyrrolizidine alkaloid isolated from Crotalaria spp. It is used for inducing pulmonary diseases in rats.
Molecular Weight:	173.21
Molecular Formula:	C11H11NO
Canonical SMILES:	COC1=CC(=CC2=CC=CC=C21)N
InChI:	InChI=1S/C11H11NO/c1-13-11-7-9(12)6-8-4-2-3-5-10(8)11/h2-7H,12H2,1H3
InChI Key:	SFKZPTYRENGBTJ-UHFFFAOYSA-N
Boiling Point:	352.9 °C at 760 mmHg
Purity:	98+ %
Density:	1.156 g/cm³
Appearance:	Light pink powder
Storage:	-20 °C
MDL:	MFCD00056592
LogP:	3.01180

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H350 (100%): May cause cancer [Danger Carcinogenicity]; H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement:	P203, P264, P270, P273, P280, P301+P317, P318, P330, P391, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
US-2020200765-A1	Broad spectrum gpcr binding agents	20181204
WO-2020117954-A2	Broad spectrum gpcr binding agents	20181204
US-2020001292-A1	Cartridge device with bypass channel for mitigating drift of fluid samples	20180629
WO-2020005455-A1	Cartridge device with bypass channel for mitigating drift of fluid samples	20180629
CN-112638532-A	Cartridge device with bypass channel for mitigating drift of fluid sample	20180629

PMID	Publication Date	Title	Journal
22683474	20120901	Flexibility of the coordination geometry around the cupric ions in Cu(II)-rat dipeptidyl peptidase III is important for the expression of enzyme activity	Archives of biochemistry and biophysics
20981445	20110301	A cysteine proteinase in the penetration glands of the cercariae of Cotylurus cornutus (Trematoda, Strigeidae)	Parasitology research
21858089	20110101	Autophagy impairment induces premature senescence in primary human fibroblasts	PloS one
21054848	20101105	Aminopeptidases do not directly degrade tau protein	Molecular neurodegeneration
19876009	20100701	Neutral aminopeptidase and dipeptidyl peptidase IV activities in plasma of monosodium glutamate obese and food-deprived rats	Obesity (Silver Spring, Md.)

Complexity:	172
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	173.084063974
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	173.084063974
Rotatable Bond Count:	1
Topological Polar Surface Area:	35.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9