4-Amino-2-methoxy-5-nitropyridine - CAS 127356-38-1

Name: 4-Amino-2-methoxy-5-nitropyridine
Brand: BOC Sciences
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Catalog:	BB006789
Product Name:	4-Amino-2-methoxy-5-nitropyridine
CAS:	127356-38-1
Synonyms:	2-methoxy-5-nitro-4-pyridinamine; 2-methoxy-5-nitropyridin-4-amine

Technical Data

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Computed Properties

IUPAC Name:	2-methoxy-5-nitropyridin-4-amine
Description:	4-Amino-2-methoxy-5-nitropyridine (CAS# 127356-38-1) is a useful research chemical.
Molecular Weight:	169.14
Molecular Formula:	C6H7N3O3
Canonical SMILES:	COC1=NC=C(C(=C1)N)[N+](=O)[O-]
InChI:	InChI=1S/C6H7N3O3/c1-12-6-2-4(7)5(3-8-6)9(10)11/h2-3H,1H3,(H2,7,8)
InChI Key:	YVXWVLIBEUMASB-UHFFFAOYSA-N
Boiling Point:	383.2 °C at 760 mmHg
Density:	1.4 g/cm³
Storage:	Keep in dark place, Inert atmosphere, 2-8 °C
LogP:	1.68500

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[76006-14-9]C6H4ClN3
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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+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-112661754-A	Polycyclic compound for inhibiting RNA helicase DHX33	20201230
TW-201946629-A	MAT2A heterobicyclic inhibitor and method for treating cancer	20180330
EP-2914615-A1	Hepatitis c virus inhibitors	20121102
TW-201422620-A	Hepatitis C virus inhibitor	20121102
US-2014127156-A1	Hepatitis C Virus Inhibitors	20121102

Complexity:	170
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	169.04874109
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	169.04874109
Rotatable Bond Count:	1
Topological Polar Surface Area:	94 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9