4-Amino-3-methoxypyridine - CAS 52334-90-4

Catalog:	BB027796
Product Name:	4-Amino-3-methoxypyridine
CAS:	52334-90-4
Synonyms:	3-methoxy-4-pyridinamine; 3-methoxypyridin-4-amine

Technical Data

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Computed Properties

IUPAC Name:	3-methoxypyridin-4-amine
Description:	4-Amino-3-methoxypyridine (CAS# 52334-90-4) is a building block used in various chemical synthesis.
Molecular Weight:	124.14
Molecular Formula:	C6H8N2O
Canonical SMILES:	COC1=C(C=CN=C1)N
InChI:	InChI=1S/C6H8N2O/c1-9-6-4-8-3-2-5(6)7/h2-4H,1H3,(H2,7,8)
InChI Key:	GPMHHELOMRCBRN-UHFFFAOYSA-N
Boiling Point:	277.8 °C at 760 mmHg
Density:	1.139 g/cm³
MDL:	MFCD09991938
LogP:	1.25360

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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, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	87.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	124.063662883
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	124.063662883
Rotatable Bond Count:	1
Topological Polar Surface Area:	48.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1