1-(4-Methylphenyl)cyclobutanemethanamine - CAS 1098362-01-6

Catalog:	BB002553
Product Name:	1-(4-Methylphenyl)cyclobutanemethanamine
CAS:	1098362-01-6
Synonyms:	[1-(4-methylphenyl)cyclobutyl]methanamine; [1-(4-methylphenyl)cyclobutyl]methanamine

Technical Data

Patents

Computed Properties

IUPAC Name:	[1-(4-methylphenyl)cyclobutyl]methanamine
Description:	1-(4-Methylphenyl)cyclobutanemethanamine (CAS# 1098362-01-6 ) is a useful research chemical.
Molecular Weight:	175.27
Molecular Formula:	C12H17N
Canonical SMILES:	CC1=CC=C(C=C1)C2(CCC2)CN
InChI:	InChI=1S/C12H17N/c1-10-3-5-11(6-4-10)12(9-13)7-2-8-12/h3-6H,2,7-9,13H2,1H3
InChI Key:	ZATVBCPKGPWCND-UHFFFAOYSA-N
LogP:	3.07570

Publication Number	Title	Priority Date
EP-2240474-B1	Cyclic pyridyl-n-(1,3,4)-thiadiazol-2-yl-benzene sulfonamides, processes for their preparation and their use as pharmaceuticals	20071226
US-2011224263-A1	Cyclic pyridyl-N-[1,3,4]-thiadiazol-2-yl-benzene sulfonamides, processes for their preparation and their use as pharmaceuticals	20071226
US-8344004-B2	Cyclic pyridyl-N-[1,3,4]-thiadiazol-2-yl-benzene sulfonamides, processes for their preparation and their use as pharmaceuticals	20071226
US-2004254158-A1	1,1-Disubstituted cycloalkyl derivatives as factor Xa inhibitors	20020510
US-7312214-B2	1, 1-disubstituted cycloalkyl derivatives as factor Xa inhibitors	20020510

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Complexity:	164
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	175.136099547
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	175.136099547
Rotatable Bond Count:	2
Topological Polar Surface Area:	26
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4