4-(Cyclopropylamino)-3-nitropyridine - CAS 380605-28-7

Name: 4-(Cyclopropylamino)-3-nitropyridine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB023520
Product Name:	4-(Cyclopropylamino)-3-nitropyridine
CAS:	380605-28-7
Synonyms:	N-cyclopropyl-3-nitro-4-pyridinamine; N-cyclopropyl-3-nitropyridin-4-amine

Technical Data

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Computed Properties

IUPAC Name:	N-cyclopropyl-3-nitropyridin-4-amine
Description:	4-(Cyclopropylamino)-3-nitropyridine (CAS# 380605-28-7) is a useful research chemical.
Molecular Weight:	179.18
Molecular Formula:	C8H9N3O2
Canonical SMILES:	C1CC1NC2=C(C=NC=C2)[N+](=O)[O-]
InChI:	InChI=1S/C8H9N3O2/c12-11(13)8-5-9-4-3-7(8)10-6-1-2-6/h3-6H,1-2H2,(H,9,10)
InChI Key:	OXWIUZUWZJVMSR-UHFFFAOYSA-N
Boiling Point:	345.645 °C at 760 mmHg
Density:	1.453 g/cm³
MDL:	MFCD11184481
LogP:	2.16030

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Publication Number	Title	Priority Date
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Complexity:	200
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	179.069476538
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	179.069476538
Rotatable Bond Count:	2
Topological Polar Surface Area:	70.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8