4-Azatricyclo[4.3.1.13,8]undecan-5-one - CAS 22607-75-6

Name: 4-Azatricyclo[4.3.1.13,8]undecan-5-one
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB017681
Product Name:	4-Azatricyclo[4.3.1.13,8]undecan-5-one
CAS:	22607-75-6
Synonyms:	4-azatricyclo[4.3.1.13,8]undecan-5-one

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Computed Properties

IUPAC Name:	4-azatricyclo[4.3.1.13,8]undecan-5-one
Description:	4-Azatricyclo[4.3.1.13,8]undecan-5-one (CAS# 22607-75-6) is a useful research chemical.
Molecular Weight:	165.23
Molecular Formula:	C10H15NO
Canonical SMILES:	C1C2CC3CC1CC(C2)NC3=O
InChI:	InChI=1S/C10H15NO/c12-10-8-2-6-1-7(3-8)5-9(4-6)11-10/h6-9H,1-5H2,(H,11,12)
InChI Key:	OKDJIRNQPPBDKJ-UHFFFAOYSA-N
Boiling Point:	344 °C at 760 mmHg
Density:	1.103 g/cm³
MDL:	MFCD00154765
LogP:	1.63990

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Related Functional Groups

Carbonyl Compounds

[51493-02-8]C5H10ClNO
N-Methyl-N-propylcarbamoyl Chloride
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]C11H21ClO
Undecanoyl chloride
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[1018141-88-2]C17H14N4O2
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
RU-2011124598-A	Method for producing 5-metoxy-4-azatricyclo [4.3.1.13,8] undec-4-ena	20110617
RU-2515500-C2	Method of obtaining 5-methoxy-4-azatricyclo[4,3,1,1 3,8]undec-4-ene	20110617
WO-2011058582-A1	Histone deacetylase inhibitors for the treatment of fungal infections	20091116
AU-2010290458-A1	Pigment dispersion including azo pigment and aqueous ink for inkjet recording using the same	20090904
AU-2010290458-B2	Pigment dispersion including azo pigment and aqueous ink for inkjet recording using the same	20090904

Complexity:	212
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	165.115364102
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	165.115364102
Rotatable Bond Count:	0
Topological Polar Surface Area:	29.1 Å²
Undefined Atom Stereocenter Count:	2
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4