CAS No.1036260-43-1,(CIS)-3-AMINOCYCLOBUTANOL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	1036260-43-1
Name:	(CIS)-3-AMINOCYCLOBUTANOL

Formula:	C₄H₉ N O
Molecular Weight:	87.12036
Synonyms:	cyclobutanol, 3-amino-, cis-;
Density:	1.153g/cm³
Boiling Point:	157.6 °C at 760 mmHg
Flash Point:	49.1 °C
PSA:	46.25000
LogP:	0.16870

Synthetic route

: 1036260-43-1
(1S,3S)-3-aminocyclobutan-1-ol

: 206257-39-8
6-bromo-4-chloroquinoline-3-carboxylic acid ethyl ester

: ethyl 6-bromo-4-[(cis-3-hydroxycyclobutyl)amino]quinoline-3-carboxylate

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In N,N-dimethyl acetamide at 80 - 90℃; Inert atmosphere;	93%

: 1036260-43-1
(1S,3S)-3-aminocyclobutan-1-ol

: 4-chloro-7-fluoro-6-(6-(methoxymethyl)pyridin-3-yl)quinoline-3-carboxamide

: 7-fluoro-4-((cis-3-hydroxycyclobutyl)amino)-6-(6-(methoxymethyl)pyridin-3-yl)quinoline-3-carboxamide

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In N,N-dimethyl acetamide Inert atmosphere; Heating;	72%

: 1036260-43-1
(1S,3S)-3-aminocyclobutan-1-ol

: 2-(5-amino-2-(furan-2-yl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl)-2-phenylpropanoic acid

: 2-(5-amino-2-(furan-2-yl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl)-N-((1s,3s)-3-hydroxycyclobutyl)-2-phenylpropanamide

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine; HATU In tetrahydrofuran at 20℃;	44%

: 1036260-43-1
(1S,3S)-3-aminocyclobutan-1-ol

: 474659-26-2
7-methoxyquinoline-3-carboxylic acid

: N-((1s,3s)-3-hydroxycyclobutyl)-7-methoxyquinoline-3-carboxamide

Conditions

Conditions	Yield
Stage #1: 7-methoxyquinoline-3-carboxylic acid With N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate In N,N-dimethyl-formamide at 20℃; for 0.0833333h; Stage #2: (1S,3S)-3-aminocyclobutan-1-ol In N,N-dimethyl-formamide	21%

: 897365-81-0
(3R,3'R,4'S,6'S,8'R,8a'S)-6-chloro-8'-(3-chloro-2-fluorophenyl)-6'-neopentyl-3',4'-diphenyl 3',4',8',8a'-tetrahydrospiro[indoline-3,7'-pyrrolo[2,1-c][1,4]oxazine]-1',2(6'H)-dione

: 1036260-43-1
(1S,3S)-3-aminocyclobutan-1-ol

: 1443749-27-6
C41H42Cl2FN3O4

Conditions

Conditions	Yield
In tetrahydrofuran at 20℃; for 12h; Inert atmosphere;	2.13 g

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Specification

The cis-3-Aminocyclobutanol with cas registry number of 1036260-43-1, is also named cyclobutanol, 3-amino-, cis- .

Physical properties of cis-3-Aminocyclobutanol : (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 2; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 46.25 Å²; (10)Index of Refraction: 1.537; (11)Molar Refractivity: 23.59 cm³; (12)Molar Volume: 75.5 cm³; (13)Polarizability: 9.35×10^-24cm³; (14)Surface Tension: 46 dyne/cm; (15)Enthalpy of Vaporization: 45.92 kJ/mol; (16)Vapour Pressure: 0.977 mmHg at 25°C .

You can still convert the following datas into molecular structure: (1)SMILES:C1[C@@H](C[C@@H]1N)O; (2)InChI:InChI=1/C4H9NO/c5-3-1-4(6)2-3/h3-4,6H,1-2,5H2/t3-,4+; (3)InChIKey:JLUZCHOYSPEHES-ZXZARUISBS; (4)Std. InChI:InChI=1S/C4H9NO/c5-3-1-4(6)2-3/h3-4,6H,1-2,5H2/t3-,4+; (5)Std. InChIKey:JLUZCHOYSPEHES-ZXZARUISSA-N.