1-[(Dibenzylamino)methyl]cyclopropanol - CAS 428855-17-8

Catalog:	BB025273
Product Name:	1-[(Dibenzylamino)methyl]cyclopropanol
CAS:	428855-17-8
Synonyms:	1-[[bis(phenylmethyl)amino]methyl]-1-cyclopropanol; 1-[(dibenzylamino)methyl]cyclopropan-1-ol

Technical Data

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Computed Properties

IUPAC Name:	1-[(dibenzylamino)methyl]cyclopropan-1-ol
Description:	1-[(Dibenzylamino)methyl]cyclopropanol (CAS# 428855-17-8) is a useful research chemical.
Molecular Weight:	267.37
Molecular Formula:	C18H21NO
Canonical SMILES:	C1CC1(CN(CC2=CC=CC=C2)CC3=CC=CC=C3)O
InChI:	InChI=1S/C18H21NO/c20-18(11-12-18)15-19(13-16-7-3-1-4-8-16)14-17-9-5-2-6-10-17/h1-10,20H,11-15H2
InChI Key:	QILKRCMMHALAJX-UHFFFAOYSA-N
Boiling Point:	383.8 °C at 760 mmHg
Density:	1.155 g/cm³
LogP:	3.21370

Publication Number	Title	Priority Date
WO-2020118683-A1	Benzamides of pyrazolyl-amino-pyrimidinyl derivatives, and compositions and methods thereof	20181214
WO-2020119819-A1	Benzamides of pyrazolyl-amino-pyrimidinyl derivatives, and compositions and methods thereof	20181214
US-2020079772-A1	Antiviral pyridopyrazinedione compounds	20180912
WO-2020053654-A1	Antiviral pyridopyrazinedione compounds	20180912
CN-112996789-A	Antiviral pyridopyrazinedione compounds	20180912

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Complexity:	268
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	267.162314293
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	267.162314293
Rotatable Bond Count:	6
Topological Polar Surface Area:	23.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9