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(8-Phenyl-1,4-dioxaspiro[4.5]dec-8-yl)methanamine

(8-Phenyl-1,4-dioxaspiro[4.5]dec-8-yl)methanamine - CAS 443687-93-2

Catalog:	BB025575
Product Name:	(8-Phenyl-1,4-dioxaspiro[4.5]dec-8-yl)methanamine
CAS:	443687-93-2
Synonyms:	(8-phenyl-1,4-dioxaspiro[4.5]decan-8-yl)methanamine; (8-phenyl-1,4-dioxaspiro[4.5]decan-8-yl)methanamine

Technical Data

Patents

Computed Properties

IUPAC Name:	(8-phenyl-1,4-dioxaspiro[4.5]decan-8-yl)methanamine
Description:	(8-Phenyl-1,4-dioxaspiro[4.5]dec-8-yl)methanamine (CAS# 443687-93-2 ) is a useful research chemical.
Molecular Weight:	247.33
Molecular Formula:	C15H21NO2
Canonical SMILES:	C1CC2(CCC1(CN)C3=CC=CC=C3)OCCO2
InChI:	InChI=1S/C15H21NO2/c16-12-14(13-4-2-1-3-5-13)6-8-15(9-7-14)17-10-11-18-15/h1-5H,6-12,16H2
InChI Key:	IHVLVGYHVPQYKR-UHFFFAOYSA-N
LogP:	2.90050

Publication Number	Title	Priority Date
EP-2260021-A1	Substituted 4-aminocyclohexane derivatives	20080327
EP-2260021-B1	Substituted 4-aminocyclohexane derivatives	20080327
EP-2502907-A1	Substituted 4-aminocyclohexane derivatives	20080327
EP-2502907-B1	Substituted 4-aminocyclohexane derivatives	20080327
EP-2518052-A1	Substituted 4-aminocyclohexane derivatives	20080327

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Complexity:	270
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	247.157228913
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	247.157228913
Rotatable Bond Count:	2
Topological Polar Surface Area:	44.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7